Basic information
- CAS
321942-74-9- Standard SMILES
O=C(CCC(=O)Nc1ccccc1O)NCCc1ccccc1- InChIKey
XDSGIRDCSJYKEJ-UHFFFAOYSA-N- Molecular formula
- C18H20N2O3
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.1473925
Names & identifiers
- Preferred name
- Butanediamide, N-(2-hydroxyphenyl)-N'-(2-phenylethyl)-
- IUPAC
- N'-(2-hydroxyphenyl)-N-(2-phenylethyl)butanediamide
Names & synonyms
321942-74-9Butanediamide, N-(2-hydroxyphenyl)-N'-(2-phenylethyl)-N'-(2-hydroxyphenyl)-N-(2-phenylethyl)butanediamideN1-(2-Hydroxyphenyl)-N4-(2-phenylethyl)butanediamideDTXSID20389228N-(2-Hydroxyphenyl)-N'-phenethylsuccinamideN~1~-(2-Hydroxyphenyl)-N~4~-(2-phenylethyl)butanediamide
Database identifiers
- CAS
321942-74-9- PubChem CID
- 3100910
- DTXSID
DTXSID20389228
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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