N-[(4-methoxyphenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
N-[(4-methoxyphenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Compound characteristics
| Compound ID: | G017-1098 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide |
| Molecular Weight: | 459.56 |
| Molecular Formula: | C23 H29 N3 O5 S |
| Smiles: | CC(C)C(C(NCc1ccc(cc1)OC)=O)NS(c1ccc2c(CCCC(N2)=O)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1734 |
| logD: | 2.1728 |
| logSw: | -2.9264 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.943 |
| InChI Key: | NWSYJDXANDHRDV-QFIPXVFZSA-N |