N-[2-(4-chlorophenyl)ethyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
N-[2-(4-chlorophenyl)ethyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Compound characteristics
Compound ID: | G017-1071 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide |
Molecular Weight: | 478.01 |
Molecular Formula: | C23 H28 Cl N3 O4 S |
Smiles: | CC(C)C(C(NCCc1ccc(cc1)[Cl])=O)NS(c1ccc2c(CCCC(N2)=O)c1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9593 |
logD: | 2.959 |
logSw: | -3.4865 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 91.241 |
InChI Key: | ZUQDXCUGNXHGQK-QFIPXVFZSA-N |