V021-1908 Screening compound: 2-fluoro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide

V021-1908 Screening compound: 2-fluoro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide
V021-1908 Screening compound: 2-fluoro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-1908
2-fluoro-N-(2-{4-[(4-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-N-(2-methylbutyl)benzamide

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

V021-1908

Molecular Formula

C28H30F2N2O3S (C28 H30 F2 N2 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCC(C)CN(CC(N(CC1)C(COc(cc2)ccc2F)c2c1scc2)=O)C(c(cccc1)c1F)=O

InChI

InChI=1S/C28H30F2N2O3S/c1-3-19(2)16-31(28(34)22-6-4-5-7-24(22)30)17-27(33)32-14-12-26-23(13-15-36-26)25(32)18-35-21-10-8-20(29)9-11-21/h4-11,13,15,19,25H,3,12,14,16-18H2,1-2H3

InChI Key

FZPMXAPIWAJRTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19867088

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.922

Distribution Coefficient, logD

5.922

Water Solubility, LogSw

-5.56

Polar Surface Area

40.286

Acid Dissociation Constant (pKa)

22.49

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V021-1908 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V021-1908 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-1908
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-1908
  • 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 V021-1908 available by request