N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide
N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V013-2684 |
| Compound Name: | N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide |
| Molecular Weight: | 323.43 |
| Molecular Formula: | C14 H17 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCSc1nnc(NC(c2cccc(c2)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5291 |
| logD: | 4.5083 |
| logSw: | -4.3127 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.779 |
| InChI Key: | IBRLIIWJFHDZKG-UHFFFAOYSA-N |