Y080-1940 Screening compound: 1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-ylhydrosulfide

Y080-1940 Screening compound: 1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-ylhydrosulfide
Y080-1940 Screening compound: 1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-ylhydrosulfide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1940
1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-ylhydrosulfide

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

Y080-1940

Molecular Formula

C14H10Cl2N2S (C14 H10 Cl2 N2 S)

Compound Name

1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-ylhydrosulfide

IUPAC name

1-[(24-dichlorophenyl)methyl]-1H-13-benzodiazole-2-thiol

SMILES

Sc1nc(cccc2)c2n1Cc(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C14H10Cl2N2S/c15-10-6-5-9(11(16)7-10)8-18-13-4-2-1-3-12(13)17-14(18)19/h1-7H,8H2,(H,17,19)

InChI Key

NBUPJWIQPRSTGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03669646

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.22

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.095

Distribution Coefficient, logD

5.090

Water Solubility, LogSw

-5.56

Polar Surface Area

9.223

Acid Dissociation Constant (pKa)

11.72

Base Dissociation Constant (pKb)

5.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

Y080-1940 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y080-1940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1940?
Check Price and Availability of Y080-1940, 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 Y080-1940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1940
  • 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 Y080-1940 available by request