2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,3-thiazole-5-carboxamide
2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D376-0425 |
| Compound Name: | 2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 422.95 |
| Molecular Formula: | C18 H19 Cl N4 O2 S2 |
| Smiles: | CC(C)c1nnc(NC(c2c(C)nc(COc3ccc(c(C)c3)[Cl])s2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.4988 |
| logD: | 4.6718 |
| logSw: | -5.9346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.18 |
| InChI Key: | SQJSZEFHSNJVAB-UHFFFAOYSA-N |