N,N-dimethyl-[6-(4-benzoylbenzoyl)-5,6,7,8-tetrahydro-4H-furo[2,3-d]azepin-2-ylmethyl]amine hydrochloride
Basic information
- Standard SMILES
CN(C)Cc1cc2c(o1)CCN(C(=O)c1ccc(C(=O)c3ccccc3)cc1)CC2.Cl- InChIKey
MPDBEWYIRVMZDL-UHFFFAOYSA-N- Molecular formula
- C25H27ClN2O3
- Average molar mass
- 438.9 g/mol
Names & identifiers
- Preferred name
- N,N-dimethyl-[6-(4-benzoylbenzoyl)-5,6,7,8-tetrahydro-4H-furo[2,3-d]azepin-2-ylmethyl]amine hydrochloride
- IUPAC
- [4-[2-[(dimethylamino)methyl]-4,5,7,8-tetrahydrofuro[2,3-d]azepine-6-carbonyl]phenyl]-phenylmethanone;hydrochloride
Names & synonyms
SCHEMBL8437586MPDBEWYIRVMZDL-UHFFFAOYSA-NN,N-dimethyl-[6-(4-benzoylbenzoyl)-5,6,7,8-tetrahydro-4H-furo[2,3-d]azepin-2-ylmethyl]amine hydrochloride
Database identifiers
- PubChem CID
- 19600246
Properties
Computed structural properties
- Topological polar surface area
- 53.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 593
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Related reactions
1 records
Compound notes
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