N-{2-chloro-5-methoxy-4-[(1-phenylethyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-{2-chloro-5-methoxy-4-[(1-phenylethyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-{2-chloro-5-methoxy-4-[(1-phenylethyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2852 |
| Compound Name: | N-{2-chloro-5-methoxy-4-[(1-phenylethyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C22 H23 Cl N2 O4 S |
| Smiles: | CC(c1ccccc1)NC(c1cc(c(cc1OC)NC(C1=C(C)OCCS1)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.111 |
| logD: | 1.2305 |
| logSw: | -4.5339 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.109 |
| InChI Key: | MKBNSHIMIZRLTN-ZDUSSCGKSA-N |