V030-8735 Screening compound: 2,4-dimethoxy-N-[3-({4-[(4-methoxyphenyl)amino]-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

V030-8735 Screening compound: 2,4-dimethoxy-N-[3-({4-[(4-methoxyphenyl)amino]-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
V030-8735 Screening compound: 2,4-dimethoxy-N-[3-({4-[(4-methoxyphenyl)amino]-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8735
2,4-dimethoxy-N-[3-({4-[(4-methoxyphenyl)amino]-1-(2-methylpropyl)-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

V030-8735

Molecular Formula

C30H31N3O6S (C30 H31 N3 O6 S)

Compound Name

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

IUPAC name

24-dimethoxy-N-[3-({4-[(4-methoxyphenyl)amino]-1-(2-methylpropyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

SMILES

CC(C)CN(C(C(Nc(cc1)ccc1OC)=C1Sc2cc(NC(c(ccc(OC)c3)c3OC)=O)ccc2)=O)C1=O

InChI

InChI=1S/C30H31N3O6S/c1-18(2)17-33-29(35)26(31-19-9-11-21(37-3)12-10-19)27(30(33)36)40-23-8-6-7-20(15-23)32-28(34)24-14-13-22(38-4)16-25(24)39-5/h6-16,18,31H,17H2,1-5H3,(H,32,34)

InChI Key

QCKWLAIERSDUHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496201

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

561.66

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.254

Distribution Coefficient, logD

5.251

Water Solubility, LogSw

-5.04

Polar Surface Area

84.684

Acid Dissociation Constant (pKa)

9.74

Base Dissociation Constant (pKb)

-1.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.30

V030-8735 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V030-8735 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8735?
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What is the minimum amount of V030-8735 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8735
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8735
  • 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 V030-8735 available by request