N-[(furan-2-yl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
N-[(furan-2-yl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Compound characteristics
Compound ID: | G017-1094 |
Compound Name: | N-[(furan-2-yl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide |
Molecular Weight: | 419.5 |
Molecular Formula: | C20 H25 N3 O5 S |
Smiles: | CC(C)C(C(NCc1ccco1)=O)NS(c1ccc2c(CCCC(N2)=O)c1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.9416 |
logD: | 1.9411 |
logSw: | -2.7733 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 99.148 |
InChI Key: | ZHUGUHRQZSODGA-IBGZPJMESA-N |