2-{4-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
Chemical Structure Depiction of
2-{4-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
2-{4-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione
Compound characteristics
| Compound ID: | SA85-1111 |
| Compound Name: | 2-{4-[6-hydroxy-4-(2-methylpropyl)-3-oxo-1,4-diazepane-1-carbonyl]phenyl}-1lambda~6~,2-thiazinane-1,1-dione |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C20 H29 N3 O5 S |
| Smiles: | CC(C)CN1CC(CN(CC1=O)C(c1ccc(cc1)N1CCCCS1(=O)=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2616 |
| logD: | 0.2616 |
| logSw: | -2.0086 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.385 |
| InChI Key: | ZHFSPGBACJLVBY-SFHVURJKSA-N |