C200-5988 Screening compound: 4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine-2-thione

C200-5988 Screening compound: 4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine-2-thione
C200-5988 Screening compound: 4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-5988
4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine-2-thione

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

C200-5988

Molecular Formula

C13H10N2S2 (C13 H10 N2 S2)

Compound Name

4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine-2-thione

IUPAC name

4-(thiophen-2-yl)-23-dihydro-1H-15-benzodiazepine-2-thione

SMILES

S=C(C1)Nc(cccc2)c2N=C1c1cccs1

InChI

InChI=1S/C13H10N2S2/c16-13-8-11(12-6-3-7-17-12)14-9-4-1-2-5-10(9)15-13/h1-7H,8H2,(H,15,16)

InChI Key

QLZJLTPKYGSCLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09981578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.294

Distribution Coefficient, logD

3.290

Water Solubility, LogSw

-3.55

Polar Surface Area

21.865

Acid Dissociation Constant (pKa)

9.45

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

C200-5988 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C200-5988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-5988?
Check Price and Availability of C200-5988, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C200-5988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-5988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-5988
  • 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 C200-5988 available by request