2,17-Dimethyl-5,16-diazatetracyclo[9.8.0.02,8.012,17]nonadec-7-ene-6,15-dione
Basic information
- CAS
5044-10-0- Standard SMILES
CC12CCC3C(CCC4=CC(=O)NCCC43C)C1CCC(=O)N2- InChIKey
DAFOSAUSDZCZOE-UHFFFAOYSA-N- Molecular formula
- C19H28N2O2
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.21507814
Names & identifiers
- Preferred name
- 2,17-Dimethyl-5,16-diazatetracyclo[9.8.0.02,8.012,17]nonadec-7-ene-6,15-dione
- IUPAC
- 2,17-dimethyl-5,16-diazatetracyclo[9.8.0.02,8.012,17]nonadec-7-ene-6,15-dione
Names & synonyms
5044-10-0NSC136992DTXSID50964683NSC-13699211a,13a-Dimethyl-4,4a,4b,5,6,10,11,11a,11b,12,13,13a-dodecahydro-3H-quinolino[6,5-g][3]benzazepine-2,8-diol
Database identifiers
- CAS
5044-10-0- PubChem CID
- 282891
- DTXSID
DTXSID50964683
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 584
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Compound notes
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