V006-4638 Screening compound: N-[4-({4-[(2-methoxy-5-methylphenyl)amino]-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]thiophene-2-carboxamide

V006-4638 Screening compound: N-[4-({4-[(2-methoxy-5-methylphenyl)amino]-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]thiophene-2-carboxamide
V006-4638 Screening compound: N-[4-({4-[(2-methoxy-5-methylphenyl)amino]-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-4638
N-[4-({4-[(2-methoxy-5-methylphenyl)amino]-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]thiophene-2-carboxamide

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

V006-4638

Molecular Formula

C30H25N3O4S2 (C30 H25 N3 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1N(C(C(Nc(cc(C)cc1)c1OC)=C1Sc(cc2)ccc2NC(c2cccs2)=O)=O)C1=O

InChI

InChI=1S/C30H25N3O4S2/c1-18-6-11-21(12-7-18)33-29(35)26(32-23-17-19(2)8-15-24(23)37-3)27(30(33)36)39-22-13-9-20(10-14-22)31-28(34)25-5-4-16-38-25/h4-17,32H,1-3H3,(H,31,34)

InChI Key

QJDJGNMOSUEKGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

555.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.744

Distribution Coefficient, logD

5.744

Water Solubility, LogSw

-5.43

Polar Surface Area

69.033

Acid Dissociation Constant (pKa)

11.36

Base Dissociation Constant (pKb)

-3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with V006-4638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-4638?
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What is the minimum amount of V006-4638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-4638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-4638
  • 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 V006-4638 available by request