V025-8439 Screening compound: 2-chloro-N-(3-{[1-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide

V025-8439 Screening compound: 2-chloro-N-(3-{[1-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
V025-8439 Screening compound: 2-chloro-N-(3-{[1-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-8439
2-chloro-N-(3-{[1-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)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

V025-8439

Molecular Formula

C32H26ClN3O5S (C32 H26 ClN3 O5 S)

Compound Name

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

IUPAC name

2-chloro-N-(3-{[1-(2-methoxy-5-methylphenyl)-4-[(4-methoxyphenyl)amino]-25-dioxo-25-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide

SMILES

Cc(cc1)cc(N(C(C(Nc(cc2)ccc2OC)=C2Sc3cccc(NC(c(cccc4)c4Cl)=O)c3)=O)C2=O)c1OC

InChI

InChI=1S/C32H26ClN3O5S/c1-19-11-16-27(41-3)26(17-19)36-31(38)28(34-20-12-14-22(40-2)15-13-20)29(32(36)39)42-23-8-6-7-21(18-23)35-30(37)24-9-4-5-10-25(24)33/h4-18,34H,1-3H3,(H,35,37)

InChI Key

GGGDHQCGOBHNOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

600.09

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.964

Distribution Coefficient, logD

5.964

Water Solubility, LogSw

-5.95

Polar Surface Area

75.956

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.40

References: we are preparing a list of scientific research reports with V025-8439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-8439?
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What is the minimum amount of V025-8439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-8439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-8439
  • 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 V025-8439 available by request