3,5-dimethoxy-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3,5-dimethoxy-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
3,5-dimethoxy-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V012-1683 |
| Compound Name: | 3,5-dimethoxy-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C20 H19 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(CSc1nnc(NC(c2cc(cc(c2)OC)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7035 |
| logD: | 4.7006 |
| logSw: | -4.3869 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.299 |
| InChI Key: | QCGKTIZVKHAMNR-UHFFFAOYSA-N |