Rmi 61213
Basic information
- CAS
56972-95-3- Standard SMILES
O=C(Nc1ccccc1)N1CCN(c2cc3ccccc3c(=O)c3ccccc23)CC1- InChIKey
PYFSXLPNNAIBDN-UHFFFAOYSA-N- Molecular formula
- C26H23N3O2
- Average molar mass
- 409.5 g/mol
- Monoisotopic mass
- 409.17902698
Names & identifiers
- Preferred name
- Rmi 61213
- IUPAC
- 4-(2-oxo-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)-N-phenylpiperazine-1-carboxamide
Names & synonyms
RMI 612134-(5-Oxo-5H-dibenzo(a,d)cyclohepten-10-yl)-N-phenyl-1-piperazinecarboxamide56972-95-3DTXSID702055601-Piperazinecarboxamide, 4-(5-oxo-5H-dibenzo(a,d)cyclohepten-10-yl)-N-phenyl-RefChem:379322DTXCID001280514-(5-Oxo-5H-dibenzo[a,d][7]annulen-10-yl)-N-phenylpiperazine-1-carboxamide
Database identifiers
- CAS
56972-95-3- PubChem CID
- 3044286
- DTXSID
DTXSID70205560
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 691
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…