V029-4437 Screening compound: 3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide

V029-4437 Screening compound: 3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide
V029-4437 Screening compound: 3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4437
3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide

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

V029-4437

Molecular Formula

C21H24ClN3O (C21 H24 ClN3 O)

Compound Name

3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide

IUPAC name

3-(5-chloro-1H-indol-3-yl)-5-methyl-N-[(pyridin-4-yl)methyl]hexanamide

SMILES

CC(C)CC(CC(NCc1ccncc1)=O)c1c[nH]c(cc2)c1cc2Cl

InChI

InChI=1S/C21H24ClN3O/c1-14(2)9-16(10-21(26)25-12-15-5-7-23-8-6-15)19-13-24-20-4-3-17(22)11-18(19)20/h3-8,11,13-14,16,24H,9-10,12H2,1-2H3,(H,25,26)/t16-/m0/s1

InChI Key

XKMBVLBRJXHYIR-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19781747

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

369.89

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.210

Distribution Coefficient, logD

4.206

Water Solubility, LogSw

-4.48

Polar Surface Area

43.737

Acid Dissociation Constant (pKa)

12.84

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V029-4437 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V029-4437 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4437?
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What is the minimum amount of V029-4437 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4437
  • 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 V029-4437 available by request