Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)OCc1ccccc1- InChIKey
YKHTXFXCBWSEFY-UHFFFAOYSA-N- Molecular formula
- C20H19BrN2O2
- Average molar mass
- 399.3 g/mol
- Monoisotopic mass
- 398.06299
Names & identifiers
- Preferred name
- Benzyl N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)carbamate
- IUPAC
- benzyl N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)carbamate
Names & synonyms
Benzyl N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)carbamate827590-50-1CHEMBL549833SCHEMBL4024163YKHTXFXCBWSEFY-UHFFFAOYSA-NEN300-28303178benzyl 6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-ylcarbamate
Database identifiers
- PubChem CID
- 11315519
- ChEMBL
CHEMBL549833
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 54.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 469
Related reactions
2 records
Compound notes
Loading…