N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V027-6883 |
| Compound Name: | N-{5-[(cyclopropylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide |
| Molecular Weight: | 309.38 |
| Molecular Formula: | C13 H12 F N3 O S2 |
| Salt: | not_available |
| Smiles: | C1CC1CSc1nnc(NC(c2cccc(c2)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9559 |
| logD: | 3.546 |
| logSw: | -4.1208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.487 |
| InChI Key: | WTSBCIMNWQKALN-UHFFFAOYSA-N |