ethyl 4-{2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}piperazine-1-carboxylate
ethyl 4-{2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | L102-0388 |
| Compound Name: | ethyl 4-{2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-1,3-thiazole-5-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 468.58 |
| Molecular Formula: | C23 H28 N6 O3 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1c(C)nc(c2c(C)n(c3ccc(C)c(C)c3)nn2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0446 |
| logD: | 4.0446 |
| logSw: | -3.9416 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.821 |
| InChI Key: | JCJDFUSLFVKDJC-UHFFFAOYSA-N |