N-(5-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(5-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
N-(5-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | V012-8349 |
| Compound Name: | N-(5-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C20 H19 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(CSc1nnc(NC(CCc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5884 |
| logD: | 4.5825 |
| logSw: | -4.5146 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.541 |
| InChI Key: | CPWDCUYEDYVWOQ-UHFFFAOYSA-N |