N-(5-{[(2,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
Chemical Structure Depiction of
N-(5-{[(2,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
N-(5-{[(2,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V014-3329 |
| Compound Name: | N-(5-{[(2,5-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-methylbutanamide |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C14 H15 F2 N3 O S2 |
| Smiles: | CC(C)CC(Nc1nnc(SCc2cc(ccc2F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6815 |
| logD: | 4.6779 |
| logSw: | -4.3567 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | JZGZRPHKWKEUNL-UHFFFAOYSA-N |