N-{4-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-{4-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-{4-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
Compound ID: | G217-1115 |
Compound Name: | N-{4-[2-(4-fluoro-2-methylanilino)-2-oxoethyl]phenyl}-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
Molecular Weight: | 431.51 |
Molecular Formula: | C26 H26 F N3 O2 |
Smiles: | Cc1cc(ccc1NC(Cc1ccc(cc1)NC(N1CCCCc2ccccc12)=O)=O)F |
Stereo: | ACHIRAL |
logP: | 5.1045 |
logD: | 5.1035 |
logSw: | -4.7761 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 46.883 |
InChI Key: | ZYYCKSLXDGFFHV-UHFFFAOYSA-N |