5225-6665 Screening compound: 3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid

5225-6665 Screening compound: 3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid
5225-6665 Screening compound: 3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5225-6665
3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid

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

5225-6665

Molecular Formula

C17H19N3O4 (C17 H19 N3 O4)

Compound Name

3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid

IUPAC name

3-[(4-methoxyphenyl)carbamoyl]-2-{[(pyridin-2-yl)methyl]amino}propanoic acid

SMILES

COc(cc1)ccc1NC(CC(C(O)=O)NCc1ncccc1)=O

InChI

InChI=1S/C17H19N3O4/c1-24-14-7-5-12(6-8-14)20-16(21)10-15(17(22)23)19-11-13-4-2-3-9-18-13/h2-9,15,19H,10-11H2,1H3,(H,20,21)(H,22,23)/t15-/m0/s1

InChI Key

SOZKGUMLCRCAIQ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD04426818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.115

Distribution Coefficient, logD

-3.072

Water Solubility, LogSw

-1.57

Polar Surface Area

80.070

Acid Dissociation Constant (pKa)

2.58

Base Dissociation Constant (pKb)

6.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.50

5225-6665 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 5225-6665 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5225-6665?
Check Price and Availability of 5225-6665, 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 5225-6665 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5225-6665
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5225-6665
  • 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 5225-6665 available by request