Basic information
- CAS
58415-38-6- Standard SMILES
O=C(NC(=S)N1CCCCC1)c1ccccc1- InChIKey
VNJFHWMMNGRADW-UHFFFAOYSA-N- Molecular formula
- C13H16N2OS
- Average molar mass
- 248.35 g/mol
- Monoisotopic mass
- 248.09833431
Names & identifiers
- Preferred name
- Benzamide, N-(1-piperidinylthioxomethyl)-
- IUPAC
- N-(piperidine-1-carbothioyl)benzamide
Names & synonyms
Benzamide, N-(1-piperidinylthioxomethyl)-58415-38-6N-(piperidine-1-carbothioyl)benzamideMaybridge4_003149CHEMBL4280260DTXSID50351296HMS1529P03CCG-48744AKOS002272129NCGC00176156-01N-[(Piperidin-1-yl)carbothioyl]benzamidephenyl-N-(piperidylthioxomethyl)carboxamide
Show more names
ST50159998SR-01000638259-1BRD-K13975047-001-01-6
Database identifiers
- CAS
58415-38-6- PubChem CID
- 696285
- DTXSID
DTXSID50351296- ChEMBL
CHEMBL4280260- Nikkaji
- J1.126.508A
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…