2-chloro-5-(2-methylpropyl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-chloro-5-(2-methylpropyl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1,3-thiazole-4-carboxamide
2-chloro-5-(2-methylpropyl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | Y042-6708 |
| Compound Name: | 2-chloro-5-(2-methylpropyl)-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 375.88 |
| Molecular Formula: | C17 H18 Cl N5 O S |
| Smiles: | CC(C)Cc1c(C(Nc2ccc(Cn3cncn3)cc2)=O)nc(s1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6004 |
| logD: | 3.5969 |
| logSw: | -4.074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.949 |
| InChI Key: | VRCLVJNLRMOBNJ-UHFFFAOYSA-N |