5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-7-chloro-10-(2-(piperidino)ethyl)-
Basic information
- CAS
3910-26-7- Standard SMILES
O=C1c2ccccc2Nc2cc(Cl)ccc2N1CCN1CCCCC1- InChIKey
UMRGWBDONVRWGB-UHFFFAOYSA-N- Molecular formula
- C20H22ClN3O
- Average molar mass
- 355.9 g/mol
- Monoisotopic mass
- 355.14514
Names & identifiers
- Preferred name
- 5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-7-chloro-10-(2-(piperidino)ethyl)-
- IUPAC
- 2-chloro-5-(2-piperidin-1-ylethyl)-11H-benzo[b][1,4]benzodiazepin-6-one
Names & synonyms
5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-7-chloro-10-(2-(piperidino)ethyl)-3910-26-7DTXSID50192348RefChem:1073485DTXCID60114839BRN 089997910,11-Dihydro-11-oxo-5H-dibenzo(b,e)(1,4)diazepine, 7-chloro-10-(2-(piperidino)ethyl)-7-Chloro-10-[2-(piperidin-1-yl)ethyl]-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-one
Database identifiers
- CAS
3910-26-7- PubChem CID
- 19791
- DTXSID
DTXSID50192348- Nikkaji
- J72.846B
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 468
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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