V020-9357 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide

V020-9357 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide
V020-9357 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9357
N-(cyclopropylmethyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide

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

V020-9357

Molecular Formula

C30H34N2O3S (C30 H34 N2 O3 S)

Compound Name

N-(cyclopropylmethyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide

IUPAC name

N-(cyclopropylmethyl)-N-(2-{4-[(24-dimethylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-4-methylbenzamide

SMILES

Cc(cc1)ccc1C(N(CC1CC1)CC(N(CC1)C(COc2c(C)cc(C)cc2)c2c1scc2)=O)=O

InChI

InChI=1S/C30H34N2O3S/c1-20-4-9-24(10-5-20)30(34)31(17-23-7-8-23)18-29(33)32-14-12-28-25(13-15-36-28)26(32)19-35-27-11-6-21(2)16-22(27)3/h4-6,9-11,13,15-16,23,26H,7-8,12,14,17-19H2,1-3H3/t26-/m0/s1

InChI Key

LKHARSOTHWHZBH-SANMLTNESA-N

MDL Number (MFCD)

MFCD19866090

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.68

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.553

Distribution Coefficient, logD

6.553

Water Solubility, LogSw

-5.64

Polar Surface Area

40.625

Acid Dissociation Constant (pKa)

22.72

Base Dissociation Constant (pKb)

1.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

V020-9357 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V020-9357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9357?
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What is the minimum amount of V020-9357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9357
  • 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 V020-9357 available by request