V013-9487 Screening compound: 3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide

V013-9487 Screening compound: 3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide
V013-9487 Screening compound: 3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-9487
3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide

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

V013-9487

Molecular Formula

C25H23ClN2O (C25 H23 ClN2 O)

Compound Name

3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide

IUPAC name

3-(2-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-phenylethyl)propanamide

SMILES

O=C(CC(c1c[nH]c2c1cccc2)c(cccc1)c1Cl)NCCc1ccccc1

InChI

InChI=1S/C25H23ClN2O/c26-23-12-6-4-10-19(23)21(22-17-28-24-13-7-5-11-20(22)24)16-25(29)27-15-14-18-8-2-1-3-9-18/h1-13,17,21,28H,14-16H2,(H,27,29)/t21-/m1/s1

InChI Key

MRCXPQJDNKYOEK-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19853613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.92

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.064

Distribution Coefficient, logD

5.064

Water Solubility, LogSw

-5.22

Polar Surface Area

33.879

Acid Dissociation Constant (pKa)

13.37

Base Dissociation Constant (pKb)

-1.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

V013-9487 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V013-9487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-9487?
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What is the minimum amount of V013-9487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-9487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-9487
  • 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 V013-9487 available by request