N-(4-{[4-(diethylamino)-2-methylphenyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(4-{[4-(diethylamino)-2-methylphenyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(4-{[4-(diethylamino)-2-methylphenyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0191 |
| Compound Name: | N-(4-{[4-(diethylamino)-2-methylphenyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C23 H27 N3 O3 S |
| Smiles: | CCN(CC)c1ccc(c(C)c1)NC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.674 |
| logD: | 3.3008 |
| logSw: | -3.9108 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.088 |
| InChI Key: | NGUVCLSDFYXNAS-UHFFFAOYSA-N |