V030-5600 Screening compound: 4-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide

V030-5600 Screening compound: 4-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
V030-5600 Screening compound: 4-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5600
4-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)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

V030-5600

Molecular Formula

C31H26ClN3O6S2 (C31 H26 ClN3 O6 S2)

Compound Name

4-chloro-N-(4-{[1-(2,4-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide

IUPAC name

4-chloro-N-(4-{[1-(24-dimethoxyphenyl)-4-[(4-methylphenyl)amino]-25-dioxo-25-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1NC(C(N(C1=O)c(ccc(OC)c2)c2OC)=O)=C1Sc(cc1)ccc1NS(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C31H26ClN3O6S2/c1-19-4-8-21(9-5-19)33-28-29(31(37)35(30(28)36)26-17-12-23(40-2)18-27(26)41-3)42-24-13-10-22(11-14-24)34-43(38,39)25-15-6-20(32)7-16-25/h4-18,33-34H,1-3H3

InChI Key

PZXGCYSPGABDPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497868

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

636.15

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.348

Distribution Coefficient, logD

6.254

Water Solubility, LogSw

-6.25

Polar Surface Area

93.514

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

-7.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.70

References: we are preparing a list of scientific research reports with V030-5600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5600?
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What is the minimum amount of V030-5600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5600
  • 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 V030-5600 available by request