3771-4666 Screening compound: 2-BENZYL-1-(4-FLUOROBENZENESULFONYL)-1H-1,3-BENZODIAZOLE
Chemical Structure Depiction of ChemDiv screening compound 3771-4666
2-BENZYL-1-(4-FLUOROBENZENESULFONYL)-1H-1,3-BENZODIAZOLE
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
3771-4666
Molecular Formula
C20H15FN2O2S (C20 H15 FN2 O2 S)
Compound Name
2-BENZYL-1-(4-FLUOROBENZENESULFONYL)-1H-1,3-BENZODIAZOLE
IUPAC name
n/a
SMILES
O=S(c(cc1)ccc1F)(n1c(cccc2)c2nc1Cc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
366.42
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.594
Distribution Coefficient, logD
4.594
Water Solubility, LogSw
-4.67
Polar Surface Area
37.258
Acid Dissociation Constant (pKa)
30.03
Base Dissociation Constant (pKb)
0.73
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.00
3771-4666 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with 3771-4666 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of 3771-4666, 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.
Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)