N-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0079 |
| Compound Name: | N-{4-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 434.9 |
| Molecular Formula: | C20 H19 Cl N2 O5 S |
| Smiles: | COc1cc(c(cc1NC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.1957 |
| logD: | 2.8748 |
| logSw: | -3.5846 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.613 |
| InChI Key: | KFPMVBGMHVZAFI-UHFFFAOYSA-N |