EX-10-542A free base
Basic information
- CAS
3297-28-7- Standard SMILES
CN1CCC(=C2c3ccccc3CN(Cc3ccccc3)c3ccccc32)CC1- InChIKey
DEBHUBICAZKJGI-UHFFFAOYSA-N- Molecular formula
- C27H28N2
- Average molar mass
- 380.5 g/mol
- Monoisotopic mass
- 380.2252489
Names & identifiers
- Preferred name
- EX-10-542A free base
- IUPAC
- 5-benzyl-11-(1-methylpiperidin-4-ylidene)-6H-benzo[c][1]benzazepine
Names & synonyms
EX-10-542A free base95ZK5SF9GYUNII-95ZK5SF9GY3297-28-75-Benzyl-11-(4-(N-methylpiperidylene))-5,6-dihydromorphanthridine5H-Dibenz(b,E)azepine, 6,11-dihydro-11-(1-methyl-4-piperidinylidene)-5-(phenylmethyl)-
Database identifiers
- CAS
3297-28-7- PubChem CID
- 31734
- UNII
- 95ZK5SF9GY
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 565
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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