V014-5032 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl N,N-diethylcarbamate

V014-5032 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl N,N-diethylcarbamate
V014-5032 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl N,N-diethylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5032
1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl N,N-diethylcarbamate

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

V014-5032

Molecular Formula

C27H24ClN3O2 (C27 H24 ClN3 O2)

Compound Name

1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl N,N-diethylcarbamate

IUPAC name

1-[(2-chlorophenyl)methyl]-4-(4-cyanophenyl)-1H-indol-5-yl NN-diethylcarbamate

SMILES

CCN(CC)C(Oc(ccc1c2ccn1Cc(cccc1)c1Cl)c2-c(cc1)ccc1C#N)=O

InChI

InChI=1S/C27H24ClN3O2/c1-3-30(4-2)27(32)33-25-14-13-24-22(26(25)20-11-9-19(17-29)10-12-20)15-16-31(24)18-21-7-5-6-8-23(21)28/h5-16H,3-4,18H2,1-2H3

InChI Key

GQFUQKKLJAKGDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10464266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.96

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.337

Distribution Coefficient, logD

6.337

Water Solubility, LogSw

-6.27

Polar Surface Area

40.829

Acid Dissociation Constant (pKa)

27.27

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

V014-5032 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V014-5032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5032?
Check Price and Availability of V014-5032, 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 V014-5032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5032
  • 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 V014-5032 available by request