3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N,N-bis(2-methylpropyl)propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N,N-bis(2-methylpropyl)propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N,N-bis(2-methylpropyl)propanamide
Compound characteristics
| Compound ID: | E511-0612 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N,N-bis(2-methylpropyl)propanamide |
| Molecular Weight: | 430.95 |
| Molecular Formula: | C19 H27 Cl N2 O5 S |
| Smiles: | CC(C)CN(CC(C)C)C(CCS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7206 |
| logD: | 2.6991 |
| logSw: | -3.5534 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.5 |
| InChI Key: | ICTMUTXBXSRPMS-UHFFFAOYSA-N |