8018-4710 Screening compound: 3-(1,2,3-thiadiazol-4-yl)aniline
Chemical Structure Depiction of ChemDiv screening compound 8018-4710
3-(1,2,3-thiadiazol-4-yl)aniline
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
8018-4710
Molecular Formula
C8H7N3S (C8 H7 N3 S)
Compound Name
3-(1,2,3-thiadiazol-4-yl)aniline
IUPAC name
3-(123-thiadiazol-4-yl)aniline
SMILES
Nc1cccc(-c2csnn2)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
177.23
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
1.479
Distribution Coefficient, logD
1.478
Water Solubility, LogSw
-1.47
Polar Surface Area
42.378
Acid Dissociation Constant (pKa)
22.98
Base Dissociation Constant (pKb)
5.62
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
8018-4710 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
Fragments Library (11262 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Fragments
References: we are preparing a list of scientific research reports with 8018-4710 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)