Basic information
- CAS
300818-40-0- Standard SMILES
Cc1ccc2nc(-c3ccc(NC(=O)c4cccnc4)cc3)sc2c1- InChIKey
NSWIVPBSYOFHRV-UHFFFAOYSA-N- Molecular formula
- C20H15N3OS
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.09358328
Names & identifiers
- Preferred name
- N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]pyridine-3-carboxamide
- IUPAC
- N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]pyridine-3-carboxamide
- English name
- N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]nicotinamide
- Molecular formula
- C20H15N3OS
- Molecular weight
- 345.42
Names & synonyms
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]pyridine-3-carboxamide300818-40-0SCHEMBL2245368N-(4-(6-METHYL-BENZOTHIAZOL-2-YL)-PHENYL)-NICOTINAMIDESTL355940AKOS000536590EU-0003984ST50182670AF-399/36690049SR-01000423949SR-01000423949-1n-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)nicotinamide
Show more names
3-Pyridinecarboxamide, N-[4-(6-methyl-2-benzothiazolyl)phenyl]-
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]nicotinamideN-[4-(6-methylbenzothiazol-2-yl)phenyl]-3-pyridylcarboxamide
Database identifiers
- CAS
300818-40-0- PubChem CID
- 692017
- EC Number
- 118-893-1
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 466
Physicochemical properties
- Density
- 1.329 · 1.329±0.06 g/cm3(Predicted)
- pka
- 11.6 · 11.60±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers3 total
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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