V030-2609 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide

V030-2609 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
V030-2609 Screening compound: N-[4-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-2609
N-[4-({4-[(4-bromophenyl)amino]-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide

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

V030-2609

Molecular Formula

C29H19BrFN3O3S (C29 H19 BrFN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cc1)ccc1F)Nc(cc1)ccc1SC(C(N(C1=O)c2ccccc2)=O)=C1Nc(cc1)ccc1Br

InChI

InChI=1S/C29H19BrFN3O3S/c30-19-8-12-21(13-9-19)32-25-26(29(37)34(28(25)36)23-4-2-1-3-5-23)38-24-16-14-22(15-17-24)33-27(35)18-6-10-20(31)11-7-18/h1-17,32H,(H,33,35)

InChI Key

AWCQPHKBERDRLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496457

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

588.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.989

Distribution Coefficient, logD

5.988

Water Solubility, LogSw

-6.11

Polar Surface Area

61.082

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with V030-2609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-2609?
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What is the minimum amount of V030-2609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-2609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-2609
  • 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 V030-2609 available by request