V018-5908 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methyl-N-propylbenzene-1-sulfonamide

V018-5908 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methyl-N-propylbenzene-1-sulfonamide
V018-5908 Screening compound: N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methyl-N-propylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-5908
N-(2-{4-[(2-fluorophenoxy)methyl]-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}-2-oxoethyl)-4-methyl-N-propylbenzene-1-sulfonamide

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

V018-5908

Molecular Formula

C26H29FN2O4S2 (C26 H29 FN2 O4 S2)

Compound Name

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

IUPAC name

N-(2-{4-[(2-fluorophenoxy)methyl]-4H5H6H7H-thieno[32-c]pyridin-5-yl}-2-oxoethyl)-4-methyl-N-propylbenzene-1-sulfonamide

SMILES

CCCN(CC(N(CC1)C(COc(cccc2)c2F)c2c1scc2)=O)S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C26H29FN2O4S2/c1-3-14-28(35(31,32)20-10-8-19(2)9-11-20)17-26(30)29-15-12-25-21(13-16-34-25)23(29)18-33-24-7-5-4-6-22(24)27/h4-11,13,16,23H,3,12,14-15,17-18H2,1-2H3/t23-/m0/s1

InChI Key

QZKMDDXTJHEBEK-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19867954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

516.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.670

Distribution Coefficient, logD

5.670

Water Solubility, LogSw

-5.45

Polar Surface Area

55.516

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with V018-5908 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V018-5908 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-5908
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-5908
  • 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 V018-5908 available by request