6-Benzyloxy-3-dimethlamino-1,2,3,4-tetrahydrocarbazole
Basic information
- CAS
176661-74-8- Standard SMILES
CN(C)C1CCc2[nH]c3ccc(OCc4ccccc4)cc3c2C1- InChIKey
JMVDTIUUNPLIRU-UHFFFAOYSA-N- Molecular formula
- C21H24N2O
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.18886339
Names & identifiers
- Preferred name
- 6-Benzyloxy-3-dimethlamino-1,2,3,4-tetrahydrocarbazole
- IUPAC
- N,N-dimethyl-6-phenylmethoxy-2,3,4,9-tetrahydro-1H-carbazol-3-amine
Names & synonyms
SCHEMBL71439006-benzyloxy-3-dimethlamino-1,2,3,4-tetrahydrocarbazoleCHEMBL3304659JMVDTIUUNPLIRU-UHFFFAOYSA-NDTXSID801157775176661-74-86-benzyloxy-3-dimethylamino-1,2,3,4-tetrahydrocarbazole6benzyloxy-3-dimethylamino-1,2,3,4-tetrahydrocarbazole2,3,4,9-Tetrahydro-N,N-dimethyl-6-(phenylmethoxy)-1H-carbazol-3-amine6-(Benzyloxy)-N,N-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-3-amine
Database identifiers
- CAS
176661-74-8- PubChem CID
- 12891778
- DTXSID
DTXSID801157775- ChEMBL
CHEMBL3304659
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 28.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 407
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Related reactions
11 records
Compound notes
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