N-(2-chloro-5-methoxy-4-{[(5-methylfuran-2-yl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-5-methoxy-4-{[(5-methylfuran-2-yl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
N-(2-chloro-5-methoxy-4-{[(5-methylfuran-2-yl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | E532-2904 |
| Compound Name: | N-(2-chloro-5-methoxy-4-{[(5-methylfuran-2-yl)methyl]carbamoyl}phenyl)-2-methyl-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 436.91 |
| Molecular Formula: | C20 H21 Cl N2 O5 S |
| Smiles: | [H]N(Cc1ccc(C)o1)C(c1cc(c(cc1OC)NC(C1=C(C)OCCS1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8985 |
| logD: | 1.018 |
| logSw: | -4.2912 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.209 |
| InChI Key: | RMZSGYJHCIJAGI-UHFFFAOYSA-N |