2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-{3-[(propan-2-yl)oxy]propyl}-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-{3-[(propan-2-yl)oxy]propyl}-1,3-thiazole-5-carboxamide
2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-{3-[(propan-2-yl)oxy]propyl}-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | L102-0425 |
| Compound Name: | 2-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-4-methyl-N-{3-[(propan-2-yl)oxy]propyl}-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C22 H29 N5 O2 S |
| Smiles: | CC(C)OCCCNC(c1c(C)nc(c2c(C)n(c3ccc(C)c(C)c3)nn2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0863 |
| logD: | 4.0863 |
| logSw: | -4.1032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.12 |
| InChI Key: | XLNBSTRJLCNSRI-UHFFFAOYSA-N |