C201-1475 Screening compound: METHYL 2-(4-SULFANYLIDENE-4,5-DIHYDRO-1H-1,5-BENZODIAZEPIN-2-YL)ACETATE

C201-1475 Screening compound: METHYL 2-(4-SULFANYLIDENE-4,5-DIHYDRO-1H-1,5-BENZODIAZEPIN-2-YL)ACETATE
C201-1475 Screening compound: METHYL 2-(4-SULFANYLIDENE-4,5-DIHYDRO-1H-1,5-BENZODIAZEPIN-2-YL)ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-1475
METHYL 2-(4-SULFANYLIDENE-4,5-DIHYDRO-1H-1,5-BENZODIAZEPIN-2-YL)ACETATE

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

C201-1475

Molecular Formula

C12H12N2O2S (C12 H12 N2 O2 S)

Compound Name

METHYL 2-(4-SULFANYLIDENE-4,5-DIHYDRO-1H-1,5-BENZODIAZEPIN-2-YL)ACETATE

IUPAC name

methyl 2-(4-sulfanylidene-45-dihydro-1H-15-benzodiazepin-2-yl)acetate

SMILES

COC(CC(Nc(cccc1)c1N1)=CC1=S)=O

InChI

InChI=1S/C12H12N2O2S/c1-16-12(15)7-8-6-11(17)14-10-5-3-2-4-9(10)13-8/h2-6,13H,7H2,1H3,(H,14,17)

InChI Key

WAKJPZIWOPBWPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11107155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.917

Distribution Coefficient, logD

1.916

Water Solubility, LogSw

-2.45

Polar Surface Area

44.412

Acid Dissociation Constant (pKa)

10.07

Base Dissociation Constant (pKb)

4.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

C201-1475 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Cardiovascular
Agro:
  • Agro
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C201-1475 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-1475?
Check Price and Availability of C201-1475, 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 C201-1475 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-1475
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-1475
  • 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 C201-1475 available by request