V030-2367 Screening compound: 3-[3-({4-[(3,4-dimethylphenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea

V030-2367 Screening compound: 3-[3-({4-[(3,4-dimethylphenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea
V030-2367 Screening compound: 3-[3-({4-[(3,4-dimethylphenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-2367
3-[3-({4-[(3,4-dimethylphenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea

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

V030-2367

Molecular Formula

C33H30N4O5S (C33 H30 N4 O5 S)

Compound Name

3-[3-({4-[(3,4-dimethylphenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea

IUPAC name

3-[3-({4-[(34-dimethylphenyl)amino]-1-(4-methoxyphenyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-1-(3-methoxyphenyl)urea

SMILES

Cc(cc1)c(C)cc1NC(C(N(C1=O)c(cc2)ccc2OC)=O)=C1Sc1cc(NC(Nc2cc(OC)ccc2)=O)ccc1

InChI

InChI=1S/C33H30N4O5S/c1-20-11-12-24(17-21(20)2)34-29-30(32(39)37(31(29)38)25-13-15-26(41-3)16-14-25)43-28-10-6-8-23(19-28)36-33(40)35-22-7-5-9-27(18-22)42-4/h5-19,34H,1-4H3,(H2,35,36,40)

InChI Key

FZMAPQXXEDLKJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497746

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

594.69

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.826

Distribution Coefficient, logD

6.826

Water Solubility, LogSw

-5.73

Polar Surface Area

85.382

Acid Dissociation Constant (pKa)

12.68

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.10

V030-2367 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V030-2367 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-2367?
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What is the minimum amount of V030-2367 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-2367
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-2367
  • 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 V030-2367 available by request