N-benzyl-2-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-benzyl-2-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carboxamide
N-benzyl-2-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | L102-0836 |
| Compound Name: | N-benzyl-2-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C21 H18 Cl N5 O S |
| Smiles: | Cc1c(C(NCc2ccccc2)=O)sc(c2c(C)n(c3ccc(cc3)[Cl])nn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3872 |
| logD: | 4.3872 |
| logSw: | -4.7034 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.806 |
| InChI Key: | HQVBSLCEMGRHQJ-UHFFFAOYSA-N |