D033-0116 Screening compound: 2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide

D033-0116 Screening compound: 2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide
D033-0116 Screening compound: 2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D033-0116
2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D033-0116

Molecular Formula

C27H27N3O4 (C27 H27 N3 O4)

Compound Name

2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide

IUPAC name

2-amino-3-(4-butoxybenzoyl)-N-(4-methoxyphenyl)indolizine-1-carboxamide

SMILES

CCCCOc(cc1)ccc1C(c(n(cccc1)c1c1C(Nc(cc2)ccc2OC)=O)c1N)=O

InChI

InChI=1S/C27H27N3O4/c1-3-4-17-34-21-12-8-18(9-13-21)26(31)25-24(28)23(22-7-5-6-16-30(22)25)27(32)29-19-10-14-20(33-2)15-11-19/h5-16H,3-4,17,28H2,1-2H3,(H,29,32)

InChI Key

FVYHOKAIHWAWFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967233

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.166

Distribution Coefficient, logD

5.166

Water Solubility, LogSw

-5.02

Polar Surface Area

69.603

Acid Dissociation Constant (pKa)

12.62

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

D033-0116 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Agro:
  • Agro
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D033-0116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D033-0116?
Check Price and Availability of D033-0116, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D033-0116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D033-0116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D033-0116
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D033-0116 available by request