N-{2-chloro-5-methoxy-4-[(2-phenylpropyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-{2-chloro-5-methoxy-4-[(2-phenylpropyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-{2-chloro-5-methoxy-4-[(2-phenylpropyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2881 |
| Compound Name: | N-{2-chloro-5-methoxy-4-[(2-phenylpropyl)carbamoyl]phenyl}-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 460.98 |
| Molecular Formula: | C23 H25 Cl N2 O4 S |
| Smiles: | CC(CNC(c1cc(c(cc1OC)NC(C1=C(C)OCCS1)=O)[Cl])=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7806 |
| logD: | 1.9001 |
| logSw: | -4.9721 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.946 |
| InChI Key: | UCJVXFHQSHEXAG-AWEZNQCLSA-N |