V011-5683 Screening compound: N~4~-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-N~1~,N~1~-dimethyl-1,4-piperidinedicarboxamide

V011-5683 Screening compound: N~4~-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-N~1~,N~1~-dimethyl-1,4-piperidinedicarboxamide
V011-5683 Screening compound: N~4~-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-N~1~,N~1~-dimethyl-1,4-piperidinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-5683
N~4~-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-N~1~,N~1~-dimethyl-1,4-piperidinedicarboxamide

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

V011-5683

Molecular Formula

C30H39FN4O3 (C30 H39 FN4 O3)

Compound Name

N~4~-{trans-4-[(4-fluorobenzoyl)(3-methylbenzyl)amino]cyclohexyl}-N~1~,N~1~-dimethyl-1,4-piperidinedicarboxamide

IUPAC name

N1N1-dimethyl-N4-[(1r4r)-4-{N-[(3-methylphenyl)methyl]4-fluorobenzamido}cyclohexyl]piperidine-14-dicarboxamide

SMILES

Cc1cccc(CN([C@H](CC2)CC[C@@H]2NC(C(CC2)CCN2C(N(C)C)=O)=O)C(c(cc2)ccc2F)=O)c1

InChI

InChI=1S/C30H39FN4O3/c1-21-5-4-6-22(19-21)20-35(29(37)24-7-9-25(31)10-8-24)27-13-11-26(12-14-27)32-28(36)23-15-17-34(18-16-23)30(38)33(2)3/h4-10,19,23,26-27H,11-18,20H2,1-3H3,(H,32,36)

InChI Key

FPQGXLOYTSNHDO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

522.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.907

Distribution Coefficient, logD

3.907

Water Solubility, LogSw

-3.88

Polar Surface Area

57.175

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

V011-5683 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V011-5683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-5683?
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What is the minimum amount of V011-5683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-5683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-5683
  • 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 V011-5683 available by request