V021-8279 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide

V021-8279 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide
V021-8279 Screening compound: N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-8279
N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide

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

V021-8279

Molecular Formula

C25H31N3O5S (C25 H31 N3 O5 S)

Compound Name

N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide

IUPAC name

N-{2-[5-(34-dimethoxyphenyl)-3-(thiophen-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)cyclobutanecarboxamide

SMILES

COCCN(CC(N(C(C1)c(cc2)cc(OC)c2OC)N=C1c1cccs1)=O)C(C1CCC1)=O

InChI

InChI=1S/C25H31N3O5S/c1-31-12-11-27(25(30)17-6-4-7-17)16-24(29)28-20(15-19(26-28)23-8-5-13-34-23)18-9-10-21(32-2)22(14-18)33-3/h5,8-10,13-14,17,20H,4,6-7,11-12,15-16H2,1-3H3/t20-/m1/s1

InChI Key

BJHQPGOHIXZSIQ-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD19800630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.953

Distribution Coefficient, logD

2.953

Water Solubility, LogSw

-3.03

Polar Surface Area

68.193

Acid Dissociation Constant (pKa)

19.21

Base Dissociation Constant (pKb)

-2.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with V021-8279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-8279?
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What is the minimum amount of V021-8279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-8279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-8279
  • 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 V021-8279 available by request