V018-4358 Screening compound: 1,3-diethyl-1-(2-{4-[(3-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)urea

V018-4358 Screening compound: 1,3-diethyl-1-(2-{4-[(3-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)urea
V018-4358 Screening compound: 1,3-diethyl-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 V018-4358
1,3-diethyl-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

V018-4358

Molecular Formula

C21H26FN3O3S (C21 H26 FN3 O3 S)

Compound Name

1,3-diethyl-1-(2-{4-[(3-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)urea

IUPAC name

13-diethyl-1-(2-{4-[(3-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)urea

SMILES

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

InChI

InChI=1S/C21H26FN3O3S/c1-3-23-21(27)24(4-2)13-20(26)25-10-8-19-17(9-11-29-19)18(25)14-28-16-7-5-6-15(22)12-16/h5-7,9,11-12,18H,3-4,8,10,13-14H2,1-2H3,(H,23,27)/t18-/m0/s1

InChI Key

RWLYCTGZSPKINO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19867687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.433

Distribution Coefficient, logD

3.433

Water Solubility, LogSw

-3.75

Polar Surface Area

50.051

Acid Dissociation Constant (pKa)

16.64

Base Dissociation Constant (pKb)

4.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

V018-4358 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 V018-4358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-4358?
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What is the minimum amount of V018-4358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-4358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-4358
  • 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 V018-4358 available by request