C200-6572 Screening compound: 2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide

C200-6572 Screening compound: 2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide
C200-6572 Screening compound: 2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-6572
2-{[4-(3-chlorophenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(2,4-difluorophenyl)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

C200-6572

Molecular Formula

C23H16ClF2N3OS (C23 H16 ClF2 N3 OS)

Compound Name

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

IUPAC name

2-{[4-(3-chlorophenyl)-3H-15-benzodiazepin-2-yl]sulfanyl}-N-(24-difluorophenyl)acetamide

SMILES

O=C(CSC(C1)=Nc(cccc2)c2N=C1c1cccc(Cl)c1)Nc(ccc(F)c1)c1F

InChI

InChI=1S/C23H16ClF2N3OS/c24-15-5-3-4-14(10-15)21-12-23(29-20-7-2-1-6-19(20)27-21)31-13-22(30)28-18-9-8-16(25)11-17(18)26/h1-11H,12-13H2,(H,28,30)

InChI Key

WELRXARTIMGNFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26961929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.92

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.228

Distribution Coefficient, logD

5.216

Water Solubility, LogSw

-5.66

Polar Surface Area

40.641

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

C200-6572 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 C200-6572 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-6572?
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What is the minimum amount of C200-6572 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-6572
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-6572
  • 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 C200-6572 available by request