3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylbutyl)propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylbutyl)propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylbutyl)propanamide
Compound characteristics
| Compound ID: | E511-0603 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylbutyl)propanamide |
| Molecular Weight: | 388.87 |
| Molecular Formula: | C16 H21 Cl N2 O5 S |
| Smiles: | CC(C)CCNC(CCS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3965 |
| logD: | 1.3751 |
| logSw: | -2.7237 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.858 |
| InChI Key: | OOWQHSVQAFGXTC-UHFFFAOYSA-N |