V021-1852 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methyl-N-[(oxolan-2-yl)methyl]propanamide

V021-1852 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methyl-N-[(oxolan-2-yl)methyl]propanamide
V021-1852 Screening compound: N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methyl-N-[(oxolan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-1852
N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-methyl-N-[(oxolan-2-yl)methyl]propanamide

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

V021-1852

Molecular Formula

C25H31FN2O4S (C25 H31 FN2 O4 S)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C25H31FN2O4S/c1-17(2)25(30)27(14-20-4-3-12-31-20)15-24(29)28-11-9-23-21(10-13-33-23)22(28)16-32-19-7-5-18(26)6-8-19/h5-8,10,13,17,20,22H,3-4,9,11-12,14-16H2,1-2H3

InChI Key

SYRPPESQRFCXRX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19867062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.715

Distribution Coefficient, logD

3.715

Water Solubility, LogSw

-3.86

Polar Surface Area

48.941

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with V021-1852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-1852?
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What is the minimum amount of V021-1852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-1852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-1852
  • 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 V021-1852 available by request