V027-2319 Screening compound: N-[4-({1-[(furan-2-yl)methyl]-4-[(2-methoxy-5-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,4-dimethoxybenzamide

V027-2319 Screening compound: N-[4-({1-[(furan-2-yl)methyl]-4-[(2-methoxy-5-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,4-dimethoxybenzamide
V027-2319 Screening compound: N-[4-({1-[(furan-2-yl)methyl]-4-[(2-methoxy-5-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,4-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-2319
N-[4-({1-[(furan-2-yl)methyl]-4-[(2-methoxy-5-methylphenyl)amino]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,4-dimethoxybenzamide

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

V027-2319

Molecular Formula

C32H29N3O7S (C32 H29 N3 O7 S)

Compound Name

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

IUPAC name

N-[4-({1-[(furan-2-yl)methyl]-4-[(2-methoxy-5-methylphenyl)amino]-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-24-dimethoxybenzamide

SMILES

Cc(cc1)cc(NC(C(N(Cc2ccco2)C2=O)=O)=C2Sc(cc2)ccc2NC(c(ccc(OC)c2)c2OC)=O)c1OC

InChI

InChI=1S/C32H29N3O7S/c1-19-7-14-26(40-3)25(16-19)34-28-29(32(38)35(31(28)37)18-22-6-5-15-42-22)43-23-11-8-20(9-12-23)33-30(36)24-13-10-21(39-2)17-27(24)41-4/h5-17,34H,18H2,1-4H3,(H,33,36)

InChI Key

ASFKDZZOZXCPII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496339

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

599.66

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

5.150

Water Solubility, LogSw

-4.91

Polar Surface Area

91.550

Acid Dissociation Constant (pKa)

9.37

Base Dissociation Constant (pKb)

-2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.60

V027-2319 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V027-2319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-2319?
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What is the minimum amount of V027-2319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-2319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-2319
  • 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 V027-2319 available by request