V023-0088 Screening compound: 4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]benzamide

V023-0088 Screening compound: 4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]benzamide
V023-0088 Screening compound: 4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-0088
4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]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

V023-0088

Molecular Formula

C28H29FN2O4S (C28 H29 FN2 O4 S)

Compound Name

4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]benzamide

IUPAC name

4-fluoro-N-{2-oxo-2-[4-(phenoxymethyl)-4H5H6H7H-thieno[32-c]pyridin-5-yl]ethyl}-N-[(oxolan-2-yl)methyl]benzamide

SMILES

O=C(CN(CC1OCCC1)C(c(cc1)ccc1F)=O)N(CC1)C(COc2ccccc2)c2c1scc2

InChI

InChI=1S/C28H29FN2O4S/c29-21-10-8-20(9-11-21)28(33)30(17-23-7-4-15-34-23)18-27(32)31-14-12-26-24(13-16-36-26)25(31)19-35-22-5-2-1-3-6-22/h1-3,5-6,8-11,13,16,23,25H,4,7,12,14-15,17-19H2

InChI Key

VNJBRKNLLAAZQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19866219

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.61

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

4.054

Distribution Coefficient, logD

4.054

Water Solubility, LogSw

-4.17

Polar Surface Area

48.669

Acid Dissociation Constant (pKa)

22.75

Base Dissociation Constant (pKb)

0.50

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V023-0088 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V023-0088 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-0088
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-0088
  • 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 V023-0088 available by request