V026-9248 Screening compound: 2,4-dichloro-N-[4-({4-[(3,4-dimethylphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

V026-9248 Screening compound: 2,4-dichloro-N-[4-({4-[(3,4-dimethylphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
V026-9248 Screening compound: 2,4-dichloro-N-[4-({4-[(3,4-dimethylphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-9248
2,4-dichloro-N-[4-({4-[(3,4-dimethylphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

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

V026-9248

Molecular Formula

C29H27Cl2N3O4S (C29 H27 Cl2 N3 O4 S)

Compound Name

2,4-dichloro-N-[4-({4-[(3,4-dimethylphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

IUPAC name

24-dichloro-N-[4-({4-[(34-dimethylphenyl)amino]-1-(3-methoxypropyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

SMILES

Cc(cc1)c(C)cc1NC(C(N(CCCOC)C1=O)=O)=C1Sc(cc1)ccc1NC(c(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C29H27Cl2N3O4S/c1-17-5-7-21(15-18(17)2)32-25-26(29(37)34(28(25)36)13-4-14-38-3)39-22-10-8-20(9-11-22)33-27(35)23-12-6-19(30)16-24(23)31/h5-12,15-16,32H,4,13-14H2,1-3H3,(H,33,35)

InChI Key

KRJLNGYAXNSTJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497246

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

584.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.472

Distribution Coefficient, logD

6.460

Water Solubility, LogSw

-6.22

Polar Surface Area

70.286

Acid Dissociation Constant (pKa)

8.96

Base Dissociation Constant (pKb)

-2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

References: we are preparing a list of scientific research reports with V026-9248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-9248?
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What is the minimum amount of V026-9248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-9248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-9248
  • 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 V026-9248 available by request