3-chloro-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-benzothiophene-2-carboxamide
3-chloro-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y030-8142 |
| Compound Name: | 3-chloro-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 415.92 |
| Molecular Formula: | C19 H14 Cl N3 O2 S2 |
| Smiles: | COc1ccc(Cc2nnc(NC(c3c(c4ccccc4s3)[Cl])=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3696 |
| logD: | 4.9291 |
| logSw: | -5.8214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.389 |
| InChI Key: | JEGVAAPCZIENIM-UHFFFAOYSA-N |