V013-6240 Screening compound: 3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)propanamide

V013-6240 Screening compound: 3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)propanamide
V013-6240 Screening compound: 3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-6240
3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)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

V013-6240

Molecular Formula

C28H29ClN2O (C28 H29 ClN2 O)

Compound Name

3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)propanamide

IUPAC name

3-(4-chlorophenyl)-3-(1-methyl-1H-indol-3-yl)-N-(4-phenylbutan-2-yl)propanamide

SMILES

CC(CCc1ccccc1)NC(CC(c1cn(C)c2c1cccc2)c(cc1)ccc1Cl)=O

InChI

InChI=1S/C28H29ClN2O/c1-20(12-13-21-8-4-3-5-9-21)30-28(32)18-25(22-14-16-23(29)17-15-22)26-19-31(2)27-11-7-6-10-24(26)27/h3-11,14-17,19-20,25H,12-13,18H2,1-2H3,(H,30,32)

InChI Key

ONOUHFOSXDYUOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852103

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.444

Distribution Coefficient, logD

6.444

Water Solubility, LogSw

-6.47

Polar Surface Area

26.168

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

25.00

V013-6240 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V013-6240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-6240?
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What is the minimum amount of V013-6240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-6240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-6240
  • 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 V013-6240 available by request