N-(1-benzylpiperidin-4-yl)-3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)propanamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)propanamide
N-(1-benzylpiperidin-4-yl)-3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E511-0638 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-3-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)propanamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C23 H26 Cl N3 O5 S |
| Smiles: | C1CN(CCC1NC(CCS(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7771 |
| logD: | 0.2194 |
| logSw: | -2.92 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.011 |
| InChI Key: | PTAHKSRCUOSYIA-UHFFFAOYSA-N |