C175-0130 Screening compound: ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate

C175-0130 Screening compound: ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate
C175-0130 Screening compound: ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C175-0130
ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate

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

C175-0130

Molecular Formula

C22H24N2O4 (C22 H24 N2 O4)

Compound Name

ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate

IUPAC name

ethyl 3-(4-butoxybenzamido)-1H-indole-2-carboxylate

SMILES

CCCCOc(cc1)ccc1C(Nc1c(C(OCC)=O)[nH]c2c1cccc2)=O

InChI

InChI=1S/C22H24N2O4/c1-3-5-14-28-16-12-10-15(11-13-16)21(25)24-19-17-8-6-7-9-18(17)23-20(19)22(26)27-4-2/h6-13,23H,3-5,14H2,1-2H3,(H,24,25)

InChI Key

ZMTCKXMTQULMDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04459930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.121

Distribution Coefficient, logD

3.751

Water Solubility, LogSw

-4.07

Polar Surface Area

60.225

Acid Dissociation Constant (pKa)

7.27

Base Dissociation Constant (pKb)

-3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C175-0130 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C175-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C175-0130?
Check Price and Availability of C175-0130, 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 C175-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C175-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C175-0130
  • 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 C175-0130 available by request