V016-6806 Screening compound: 1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide

V016-6806 Screening compound: 1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide
V016-6806 Screening compound: 1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6806
1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide

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

V016-6806

Molecular Formula

C24H27ClN2O2 (C24 H27 ClN2 O2)

Compound Name

1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide

IUPAC name

1-[(2-chlorophenyl)methyl]-N-cyclohexyl-4-ethoxy-1H-indole-2-carboxamide

SMILES

CCOc1cccc2c1cc(C(NC1CCCCC1)=O)n2Cc(cccc1)c1Cl

InChI

InChI=1S/C24H27ClN2O2/c1-2-29-23-14-8-13-21-19(23)15-22(24(28)26-18-10-4-3-5-11-18)27(21)16-17-9-6-7-12-20(17)25/h6-9,12-15,18H,2-5,10-11,16H2,1H3,(H,26,28)

InChI Key

AXVPEAVWIQXQSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14247947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.438

Distribution Coefficient, logD

6.438

Water Solubility, LogSw

-6.15

Polar Surface Area

32.041

Acid Dissociation Constant (pKa)

15.28

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

V016-6806 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 V016-6806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6806?
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What is the minimum amount of V016-6806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6806
  • 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 V016-6806 available by request