2-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-(propan-2-yl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-(propan-2-yl)-1,3-thiazole-4-carboxamide
2-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-(propan-2-yl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5932 |
| Compound Name: | 2-bromo-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-(propan-2-yl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 453.38 |
| Molecular Formula: | C17 H17 Br N4 O2 S2 |
| Smiles: | CC(C)c1c(C(Nc2nnc(Cc3ccc(cc3)OC)s2)=O)nc(s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0972 |
| logD: | 3.5012 |
| logSw: | -4.8661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.768 |
| InChI Key: | ASASDXBEZLLOSV-UHFFFAOYSA-N |