V008-6980 Screening compound: N-{2-[4-(4-tert-butylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-2,4,6-trimethyl-N-(2-methylpropyl)benzene-1-sulfonamide

V008-6980 Screening compound: N-{2-[4-(4-tert-butylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-2,4,6-trimethyl-N-(2-methylpropyl)benzene-1-sulfonamide
V008-6980 Screening compound: N-{2-[4-(4-tert-butylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-2,4,6-trimethyl-N-(2-methylpropyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-6980
N-{2-[4-(4-tert-butylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-2,4,6-trimethyl-N-(2-methylpropyl)benzene-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

V008-6980

Molecular Formula

C32H42N2O3S2 (C32 H42 N2 O3 S2)

Compound Name

N-{2-[4-(4-tert-butylphenyl)-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl}-2,4,6-trimethyl-N-(2-methylpropyl)benzene-1-sulfonamide

IUPAC name

N-{2-[4-(4-tert-butylphenyl)-4H5H6H7H-thieno[32-c]pyridin-5-yl]-2-oxoethyl}-246-trimethyl-N-(2-methylpropyl)benzene-1-sulfonamide

SMILES

CC(C)CN(CC(N(CCc1c2ccs1)C2c1ccc(C(C)(C)C)cc1)=O)S(c1c(C)cc(C)cc1C)(=O)=O

InChI

InChI=1S/C32H42N2O3S2/c1-21(2)19-33(39(36,37)31-23(4)17-22(3)18-24(31)5)20-29(35)34-15-13-28-27(14-16-38-28)30(34)25-9-11-26(12-10-25)32(6,7)8/h9-12,14,16-18,21,30H,13,15,19-20H2,1-8H3/t30-/m1/s1

InChI Key

ZZCOCENPRAWQQU-SSEXGKCCSA-N

MDL Number (MFCD)

MFCD19754623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

566.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

8.559

Distribution Coefficient, logD

8.559

Water Solubility, LogSw

-5.61

Polar Surface Area

47.999

Acid Dissociation Constant (pKa)

22.48

Base Dissociation Constant (pKb)

-3.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.90

References: we are preparing a list of scientific research reports with V008-6980 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-6980?
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What is the minimum amount of V008-6980 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-6980
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-6980
  • 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 V008-6980 available by request