N-[(3-methoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
N-[(3-methoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E977-0540 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-1-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C24 H29 N3 O5 S |
| Smiles: | COc1cccc(CNC(C2CCN(CC2)S(c2ccc3c(CCCC(N3)=O)c2)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.9201 |
| logD: | 1.92 |
| logSw: | -2.7659 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.058 |
| InChI Key: | CBGKHLTZXDCSIY-UHFFFAOYSA-N |