V030-8058 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,3-dichlorobenzene-1-sulfonamide

V030-8058 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,3-dichlorobenzene-1-sulfonamide
V030-8058 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,3-dichlorobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8058
N-[4-({4-[(4-bromophenyl)amino]-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2,3-dichlorobenzene-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

V030-8058

Molecular Formula

C27H18BrCl2N3O5S2 (C27 H18 BrCl2 N3 O5 S2)

Compound Name

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

IUPAC name

N-[4-({4-[(4-bromophenyl)amino]-1-[(furan-2-yl)methyl]-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-23-dichlorobenzene-1-sulfonamide

SMILES

O=C(C(Nc(cc1)ccc1Br)=C1Sc(cc2)ccc2NS(c(cccc2Cl)c2Cl)(=O)=O)N(Cc2ccco2)C1=O

InChI

InChI=1S/C27H18BrCl2N3O5S2/c28-16-6-8-17(9-7-16)31-24-25(27(35)33(26(24)34)15-19-3-2-14-38-19)39-20-12-10-18(11-13-20)32-40(36,37)22-5-1-4-21(29)23(22)30/h1-14,31-32H,15H2

InChI Key

PPIRWUVTGSGTSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497314

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

679.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.782

Distribution Coefficient, logD

6.744

Water Solubility, LogSw

-6.55

Polar Surface Area

87.001

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.70

References: we are preparing a list of scientific research reports with V030-8058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8058?
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What is the minimum amount of V030-8058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8058
  • 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 V030-8058 available by request