V002-9164 Screening compound: N-(3-{2-[cyclohexyl(methyl)amino]ethyl}-1H-indol-5-yl)-4-pentylbenzamide

V002-9164 Screening compound: N-(3-{2-[cyclohexyl(methyl)amino]ethyl}-1H-indol-5-yl)-4-pentylbenzamide
V002-9164 Screening compound: N-(3-{2-[cyclohexyl(methyl)amino]ethyl}-1H-indol-5-yl)-4-pentylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-9164
N-(3-{2-[cyclohexyl(methyl)amino]ethyl}-1H-indol-5-yl)-4-pentylbenzamide

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

V002-9164

Molecular Formula

C29H39N3O (C29 H39 N3 O)

Compound Name

N-(3-{2-[cyclohexyl(methyl)amino]ethyl}-1H-indol-5-yl)-4-pentylbenzamide

IUPAC name

n/a

SMILES

CCCCCc(cc1)ccc1C(Nc(cc1)cc2c1[nH]cc2CCN(C)C1CCCCC1)=O

InChI

InChI=1S/C29H39N3O/c1-3-4-6-9-22-12-14-23(15-13-22)29(33)31-25-16-17-28-27(20-25)24(21-30-28)18-19-32(2)26-10-7-5-8-11-26/h12-17,20-21,26,30H,3-11,18-19H2,1-2H3,(H,31,33)

InChI Key

NBCYTPJCAKZOJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19964920

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

445.65

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.159

Distribution Coefficient, logD

5.264

Water Solubility, LogSw

-5.72

Polar Surface Area

35.967

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

9.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

V002-9164 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V002-9164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-9164?
Check Price and Availability of V002-9164, 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 V002-9164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-9164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-9164
  • 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 V002-9164 available by request