methyl 2-{[4-(ethoxycarbonyl)phenyl]imino}-3-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl 2-{[4-(ethoxycarbonyl)phenyl]imino}-3-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate--hydrogen chloride (1/1)
methyl 2-{[4-(ethoxycarbonyl)phenyl]imino}-3-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C636-0331 |
| Compound Name: | methyl 2-{[4-(ethoxycarbonyl)phenyl]imino}-3-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 498 |
| Molecular Formula: | C22 H27 N3 O6 S |
| Salt: | HCl |
| Smiles: | CCOC(c1ccc(cc1)/N=C1/N(CCCN2CCOCC2)C(C=C(C(=O)OC)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5422 |
| logD: | 2.4592 |
| logSw: | -2.5178 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 78.844 |
| InChI Key: | CYPRETKROIGJNW-FCQUAONHSA-N |