V021-6487 Screening compound: 1-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-[(oxolan-2-yl)methyl]-3-propylurea

V021-6487 Screening compound: 1-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-[(oxolan-2-yl)methyl]-3-propylurea
V021-6487 Screening compound: 1-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-[(oxolan-2-yl)methyl]-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6487
1-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-1-[(oxolan-2-yl)methyl]-3-propylurea

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

V021-6487

Molecular Formula

C25H32FN3O4S (C25 H32 FN3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCCNC(N(CC1OCCC1)CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O)=O

InChI

InChI=1S/C25H32FN3O4S/c1-2-11-27-25(31)28(15-20-4-3-13-32-20)16-24(30)29-12-9-23-21(10-14-34-23)22(29)17-33-19-7-5-18(26)6-8-19/h5-8,10,14,20,22H,2-4,9,11-13,15-17H2,1H3,(H,27,31)

InChI Key

DXYFDQAUKVOIBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19867772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.817

Distribution Coefficient, logD

3.817

Water Solubility, LogSw

-3.72

Polar Surface Area

58.925

Acid Dissociation Constant (pKa)

17.04

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.00

V021-6487 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 V021-6487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6487?
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What is the minimum amount of V021-6487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6487
  • 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 V021-6487 available by request