V031-3281 Screening compound: N-{2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclobutanecarboxamide

V031-3281 Screening compound: N-{2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclobutanecarboxamide
V031-3281 Screening compound: N-{2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-3281
N-{2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]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

V031-3281

Molecular Formula

C27H34N4O4S (C27 H34 N4 O4 S)

Compound Name

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

IUPAC name

N-{2-[5-(2-methoxyphenyl)-3-(thiophen-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]cyclobutanecarboxamide

SMILES

COc1c(C(C2)N(C(CN(CCN3CCOCC3)C(C3CCC3)=O)=O)N=C2c2cccs2)cccc1

InChI

InChI=1S/C27H34N4O4S/c1-34-24-9-3-2-8-21(24)23-18-22(25-10-5-17-36-25)28-31(23)26(32)19-30(27(33)20-6-4-7-20)12-11-29-13-15-35-16-14-29/h2-3,5,8-10,17,20,23H,4,6-7,11-16,18-19H2,1H3/t23-/m1/s1

InChI Key

LQLULISDFFZSKG-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19807426

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

510.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.095

Distribution Coefficient, logD

3.063

Water Solubility, LogSw

-3.08

Polar Surface Area

63.840

Acid Dissociation Constant (pKa)

19.21

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

51.90

References: we are preparing a list of scientific research reports with V031-3281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-3281?
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What is the minimum amount of V031-3281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-3281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-3281
  • 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 V031-3281 available by request