Basic information
- Standard SMILES
CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)cn1.Cl- InChIKey
JDVXFQPNVNBOQL-PKLMIRHRSA-N- Molecular formula
- C18H21Cl2N3O3
- Average molar mass
- 398.3 g/mol
- Monoisotopic mass
- 397.0959969
Names & identifiers
- Preferred name
- (S)-N-(3-Chloro-4-(morpholin-2-yl)phenyl)-6-ethoxynicotinamide hydrochloride
- IUPAC
- N-[3-chloro-4-[(2S)-morpholin-2-yl]phenyl]-6-ethoxypyridine-3-carboxamide;hydrochloride
Names & synonyms
SCHEMBL14151758JDVXFQPNVNBOQL-PKLMIRHRSA-N(S)-N-(3-Chloro-4-(morpholin-2-yl)phenyl)-6-ethoxynicotinamide hydrochloride
Database identifiers
- PubChem CID
- 71087322
Properties
Computed structural properties
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 440
Related reactions
1 records
Compound notes
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