3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]propanamide
Chemical Structure Depiction of
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]propanamide
3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]propanamide
Compound characteristics
| Compound ID: | E511-0673 |
| Compound Name: | 3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[4-(diethylamino)-2-methylphenyl]propanamide |
| Molecular Weight: | 479.98 |
| Molecular Formula: | C22 H26 Cl N3 O5 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(CCS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6058 |
| logD: | 2.3751 |
| logSw: | -3.4744 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.461 |
| InChI Key: | PMEMYRABRLXGQL-UHFFFAOYSA-N |