V011-6741 Screening compound: 3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)urea

V011-6741 Screening compound: 3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)urea
V011-6741 Screening compound: 3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6741
3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)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

V011-6741

Molecular Formula

C23H29N3O3S (C23 H29 N3 O3 S)

Compound Name

3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)urea

IUPAC name

3-ethyl-1-(2-{4-[(2-methylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-1-(prop-2-en-1-yl)urea

SMILES

CCNC(N(CC=C)CC(N(CC1)C(COc2c(C)cccc2)c2c1scc2)=O)=O

InChI

InChI=1S/C23H29N3O3S/c1-4-12-25(23(28)24-5-2)15-22(27)26-13-10-21-18(11-14-30-21)19(26)16-29-20-9-7-6-8-17(20)3/h4,6-9,11,14,19H,1,5,10,12-13,15-16H2,2-3H3,(H,24,28)/t19-/m0/s1

InChI Key

VPZHULPZTJFMMS-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19867830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.57

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

4.130

Distribution Coefficient, logD

4.130

Water Solubility, LogSw

-4.13

Polar Surface Area

50.392

Acid Dissociation Constant (pKa)

16.56

Base Dissociation Constant (pKb)

5.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

V011-6741 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 V011-6741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6741?
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What is the minimum amount of V011-6741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6741
  • 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 V011-6741 available by request