N-(2-amino-1-benzylsulfanyl-2-oxoethyl)benzamide
Basic information
- CAS
31657-20-2- Standard SMILES
NC(=O)C(NC(=O)c1ccccc1)SCc1ccccc1- InChIKey
QDQWKLNQYZGFCX-UHFFFAOYSA-N- Molecular formula
- C16H16N2O2S
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.09324893
Names & identifiers
- Preferred name
- N-(2-amino-1-benzylsulfanyl-2-oxoethyl)benzamide
- IUPAC
- N-(2-amino-1-benzylsulfanyl-2-oxoethyl)benzamide
Names & synonyms
31657-20-2N-(2-amino-1-benzylsulfanyl-2-oxoethyl)benzamideNSC177928CHEMBL3900399DTXSID90306609NSC-177928DS-006557N-[2-amino-1-(benzylsulfanyl)-2-oxoethyl]benzamideBENZAMIDE,N-[2-AMINO-2-OXO-1-[(PHENYLMETHYL)THIO]ETHYL]-
Database identifiers
- CAS
31657-20-2- PubChem CID
- 301308
- DTXSID
DTXSID90306609- ChEMBL
CHEMBL3900399
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 97.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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