V030-2446 Screening compound: N-[3-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzenesulfonamide

V030-2446 Screening compound: N-[3-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzenesulfonamide
V030-2446 Screening compound: N-[3-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-2446
N-[3-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzenesulfonamide

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

V030-2446

Molecular Formula

C28H20BrN3O4S2 (C28 H20 BrN3 O4 S2)

Compound Name

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

IUPAC name

N-[3-({4-[(4-bromophenyl)amino]-25-dioxo-1-phenyl-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzenesulfonamide

SMILES

O=C(C(Nc(cc1)ccc1Br)=C(C1=O)Sc2cc(NS(c3ccccc3)(=O)=O)ccc2)N1c1ccccc1

InChI

InChI=1S/C28H20BrN3O4S2/c29-19-14-16-20(17-15-19)30-25-26(28(34)32(27(25)33)22-9-3-1-4-10-22)37-23-11-7-8-21(18-23)31-38(35,36)24-12-5-2-6-13-24/h1-18,30-31H

InChI Key

MWFPBOGXYIOWMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496929

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

606.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.578

Distribution Coefficient, logD

5.555

Water Solubility, LogSw

-5.83

Polar Surface Area

78.641

Acid Dissociation Constant (pKa)

8.66

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

V030-2446 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 V030-2446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-2446?
Check Price and Availability of V030-2446, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V030-2446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-2446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-2446
  • 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 V030-2446 available by request