C200-6593 Screening compound: N-(3,4-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide

C200-6593 Screening compound: N-(3,4-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
C200-6593 Screening compound: N-(3,4-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-6593
N-(3,4-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide

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

C200-6593

Molecular Formula

C26H25N3O2S (C26 H25 N3 O2 S)

Compound Name

N-(3,4-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide

IUPAC name

N-(34-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-3H-15-benzodiazepin-2-yl]sulfanyl}acetamide

SMILES

Cc(cc1)c(C)cc1NC(CSC(C1)=Nc(cccc2)c2N=C1c1cc(OC)ccc1)=O

InChI

InChI=1S/C26H25N3O2S/c1-17-11-12-20(13-18(17)2)27-25(30)16-32-26-15-24(19-7-6-8-21(14-19)31-3)28-22-9-4-5-10-23(22)29-26/h4-14H,15-16H2,1-3H3,(H,27,30)

InChI Key

IHMSOIUPJIHCQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26961934

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.698

Distribution Coefficient, logD

5.698

Water Solubility, LogSw

-5.44

Polar Surface Area

48.883

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

C200-6593 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with C200-6593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-6593?
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What is the minimum amount of C200-6593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-6593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-6593
  • 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 C200-6593 available by request