V012-7941 Screening compound: 1-(CYCLOPROPYLMETHYL)-3-ETHYL-1-(2-{4-[(3-FLUOROPHENOXY)METHYL]-4H,5H,6H,7H-THIENO[3,2-C]PYRIDIN-5-YL}-2-OXOETHYL)UREA

V012-7941 Screening compound: 1-(CYCLOPROPYLMETHYL)-3-ETHYL-1-(2-{4-[(3-FLUOROPHENOXY)METHYL]-4H,5H,6H,7H-THIENO[3,2-C]PYRIDIN-5-YL}-2-OXOETHYL)UREA
V012-7941 Screening compound: 1-(CYCLOPROPYLMETHYL)-3-ETHYL-1-(2-{4-[(3-FLUOROPHENOXY)METHYL]-4H,5H,6H,7H-THIENO[3,2-C]PYRIDIN-5-YL}-2-OXOETHYL)UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-7941
1-(CYCLOPROPYLMETHYL)-3-ETHYL-1-(2-{4-[(3-FLUOROPHENOXY)METHYL]-4H,5H,6H,7H-THIENO[3,2-C]PYRIDIN-5-YL}-2-OXOETHYL)UREA

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

V012-7941

Molecular Formula

C23H28FN3O3S (C23 H28 FN3 O3 S)

Compound Name

1-(CYCLOPROPYLMETHYL)-3-ETHYL-1-(2-{4-[(3-FLUOROPHENOXY)METHYL]-4H,5H,6H,7H-THIENO[3,2-C]PYRIDIN-5-YL}-2-OXOETHYL)UREA

IUPAC name

n/a

SMILES

CCNC(N(CC1CC1)CC(N(CC1)C(COc2cc(F)ccc2)c2c1scc2)=O)=O

InChI

InChI=1S/C23H28FN3O3S/c1-2-25-23(29)26(13-16-6-7-16)14-22(28)27-10-8-21-19(9-11-31-21)20(27)15-30-18-5-3-4-17(24)12-18/h3-5,9,11-12,16,20H,2,6-8,10,13-15H2,1H3,(H,25,29)/t20-/m0/s1

InChI Key

WJFYWTVYDKHYEF-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19867717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.014

Distribution Coefficient, logD

4.014

Water Solubility, LogSw

-4.03

Polar Surface Area

50.578

Acid Dissociation Constant (pKa)

16.64

Base Dissociation Constant (pKb)

4.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.80

V012-7941 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V012-7941 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-7941?
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What is the minimum amount of V012-7941 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-7941
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-7941
  • 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 V012-7941 available by request