2-methyl-N-(2-{[2-(3,4,5-trimethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Chemical Structure Depiction of
2-methyl-N-(2-{[2-(3,4,5-trimethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
2-methyl-N-(2-{[2-(3,4,5-trimethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide
Compound characteristics
| Compound ID: | C799-0513 |
| Compound Name: | 2-methyl-N-(2-{[2-(3,4,5-trimethoxyphenyl)ethyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-3-carboxamide |
| Molecular Weight: | 472.56 |
| Molecular Formula: | C24 H28 N2 O6 S |
| Smiles: | CC1=C(C(Nc2ccccc2C(NCCc2cc(c(c(c2)OC)OC)OC)=O)=O)SCCO1 |
| Stereo: | ACHIRAL |
| logP: | 2.0449 |
| logD: | 1.6343 |
| logSw: | -3.147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.135 |
| InChI Key: | KGMBTLDGVAYTLW-UHFFFAOYSA-N |