N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-chloro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-chloro-1-benzothiophene-2-carboxamide
N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-chloro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y031-0986 |
| Compound Name: | N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-chloro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 351.87 |
| Molecular Formula: | C15 H14 Cl N3 O S2 |
| Smiles: | CCCCc1nnc(NC(c2c(c3ccccc3s2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.342 |
| logD: | 4.4012 |
| logSw: | -5.7107 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.117 |
| InChI Key: | LPWVTWIFIXNUBX-UHFFFAOYSA-N |