6-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-sulfonyl]-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-sulfonyl]-3-methyl-1,3-benzoxazol-2(3H)-one
6-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-sulfonyl]-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SA85-1175 |
| Compound Name: | 6-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-sulfonyl]-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C17 H23 N3 O6 S |
| Smiles: | CC(C)CN1CC(CN(CC1=O)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.561 |
| logD: | 0.561 |
| logSw: | -2.3078 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.644 |
| InChI Key: | JAADOFQCNKTWFD-LBPRGKRZSA-N |