N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | V012-0491 |
| Compound Name: | N-(5-{[(2,6-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide |
| Molecular Weight: | 393.43 |
| Molecular Formula: | C17 H13 F2 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)C(Nc1nnc(SCc2c(cccc2F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6878 |
| logD: | 4.6648 |
| logSw: | -4.3984 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.508 |
| InChI Key: | ZMMAQTPTEFWLJG-UHFFFAOYSA-N |