V012-3901 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide

V012-3901 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide
V012-3901 Screening compound: N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-3901
N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide

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

V012-3901

Molecular Formula

C31H39ClN4O3 (C31 H39 ClN4 O3)

Compound Name

N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide

IUPAC name

N-{2-[5-(4-chlorophenyl)-3-(34-dimethylphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclopentanecarboxamide

SMILES

Cc(cc1)c(C)cc1C(CC1c(cc2)ccc2Cl)=NN1C(CN(CCN1CCOCC1)C(C1CCCC1)=O)=O

InChI

InChI=1S/C31H39ClN4O3/c1-22-7-8-26(19-23(22)2)28-20-29(24-9-11-27(32)12-10-24)36(33-28)30(37)21-35(31(38)25-5-3-4-6-25)14-13-34-15-17-39-18-16-34/h7-12,19,25,29H,3-6,13-18,20-21H2,1-2H3/t29-/m0/s1

InChI Key

JTFNIOFAUGINJX-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD19797751

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

551.13

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.566

Distribution Coefficient, logD

5.534

Water Solubility, LogSw

-6.14

Polar Surface Area

55.226

Acid Dissociation Constant (pKa)

18.65

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

51.60

References: we are preparing a list of scientific research reports with V012-3901 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-3901?
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What is the minimum amount of V012-3901 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-3901
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-3901
  • 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 V012-3901 available by request