Carbamic acid, (5-((dimethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, methyl ester, monohydrochloride
Basic information
- CAS
105774-17-2- Standard SMILES
COC(=O)Nc1ccc2c(c1)N(C(=O)CN(C)C)c1ccccc1CC2.Cl- InChIKey
WIRLAAXPZWYWPN-UHFFFAOYSA-N- Molecular formula
- C20H24ClN3O3
- Average molar mass
- 389.9 g/mol
- Monoisotopic mass
- 389.1506193
Names & identifiers
- Preferred name
- Carbamic acid, (5-((dimethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, methyl ester, monohydrochloride
- IUPAC
- methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride
Names & synonyms
105774-17-2Carbamic acid, (5-((dimethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, methyl ester, monohydrochlorideDTXSID40147327RefChem:332151DTXCID2069818methyl (5-(2-(dimethylamino)acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochlorideAKOS030506006methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochlorideMethyl [5-(N,N-dimethylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate--hydrogen chloride (1/1)
Database identifiers
- CAS
105774-17-2- PubChem CID
- 3064802
- DTXSID
DTXSID40147327
Properties
Computed structural properties
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 511
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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