Basic information
- CAS
14269-45-5- Standard SMILES
O=C(Nc1nc(-c2ccccc2)cs1)c1ccccc1- InChIKey
NIRMZOKDACPPER-UHFFFAOYSA-N- Molecular formula
- C16H12N2OS
- Average molar mass
- 280.3 g/mol
- Monoisotopic mass
- 280.06703418
Names & identifiers
- Preferred name
- N-(4-Phenyl-thiazol-2-yl)-benzamide
- IUPAC
- N-(4-phenyl-1,3-thiazol-2-yl)benzamide
- English name
- Benzamide, N-(4-phenyl-2-thiazolyl)-
- Molecular formula
- C16H12N2OS
- Molecular weight
- 280.34
Names & synonyms
14269-45-5N-(4-Phenyl-thiazol-2-yl)-benzamideRefChem:362237N-(4-phenyl-1,3-thiazol-2-yl)benzamideCHEMBL60334N-(4-phenylthiazol-2-yl)benzamideEnamine_004302Cambridge id 5149845Oprea1_007140Oprea1_016303Oprea1_4620062-Benzamido-4-phenylthiazole
Show more names
Benzamide, N-(4-phenyl-2-thiazolyl)-
CBDivE_004384SCHEMBL1270375SCHEMBL18874193DTXSID10353610HMS1406D12BDBM50101790EBC-07032STK337540
Database identifiers
- CAS
14269-45-5- PubChem CID
- 746475
- DTXSID
DTXSID10353610- ChEMBL
CHEMBL60334- Nikkaji
- J1.266.303J
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Physicochemical properties
- Melting point
- 135 °C · 135 °C
- Density
- 1.296 · 1.296±0.06 g/cm3(Predicted)
- pka
- 7.04 · 7.04±0.70(Predicted)
Chemistry & industry
Suppliers3 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
MolMall Sarl[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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