Y030-8739 Screening compound: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-chloro-1-benzenesulfonamide
Chemical Structure Depiction of ChemDiv screening compound Y030-8739
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-chloro-1-benzenesulfonamide
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
Y030-8739
Molecular Formula
C15H12ClN3O2S2 (C15 H12 ClN3 O2 S2)
Compound Name
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-chloro-1-benzenesulfonamide
IUPAC name
N-(5-benzyl-134-thiadiazol-2-yl)-4-chlorobenzene-1-sulfonamide
SMILES
O=S(c(cc1)ccc1Cl)(Nc1nnc(Cc2ccccc2)s1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
365.86
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.904
Distribution Coefficient, logD
1.074
Water Solubility, LogSw
-4.44
Polar Surface Area
64.657
Acid Dissociation Constant (pKa)
4.57
Base Dissociation Constant (pKb)
-3.57
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.67
Y030-8739 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Antifungal Library (16415 compounds)
PI3K-Targeted Library (17255 compounds)
Type II Kinase Inhibitors Library (6956 compounds)
Included in 1.7M Stock Database
- Immune system
- Infections
- Immune system
- animal
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Digestive system
- Hemic and lymphatic
- Endocrine
- Agro
- Kinases
- Kinases
References: we are preparing a list of scientific research reports with Y030-8739 chemical compound. It will be published here after verification.
Frequently Asked Questions
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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)