V011-1849 Screening compound: N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide

V011-1849 Screening compound: N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide
V011-1849 Screening compound: N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-1849
N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)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

V011-1849

Molecular Formula

C28H29FN2O3S (C28 H29 FN2 O3 S)

Compound Name

N-(2-{4-[(2,4-dimethylphenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide

IUPAC name

N-(2-{4-[(24-dimethylphenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-2-fluoro-N-(prop-2-en-1-yl)benzamide

SMILES

Cc(cc1)cc(C)c1OCC(c1c(CC2)scc1)N2C(CN(CC=C)C(c(cccc1)c1F)=O)=O

InChI

InChI=1S/C28H29FN2O3S/c1-4-13-30(28(33)21-7-5-6-8-23(21)29)17-27(32)31-14-11-26-22(12-15-35-26)24(31)18-34-25-10-9-19(2)16-20(25)3/h4-10,12,15-16,24H,1,11,13-14,17-18H2,2-3H3/t24-/m0/s1

InChI Key

TXVSWBQOBQHWNT-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD19979007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.891

Distribution Coefficient, logD

5.891

Water Solubility, LogSw

-5.53

Polar Surface Area

40.351

Acid Dissociation Constant (pKa)

22.51

Base Dissociation Constant (pKb)

0.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V011-1849 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-1849?
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What is the minimum amount of V011-1849 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-1849
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-1849
  • 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 V011-1849 available by request