N-(4-acetamidophenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide
N-(4-acetamidophenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | 8544-0655 |
| Compound Name: | N-(4-acetamidophenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 452.47 |
| Molecular Formula: | C25 H20 N6 O3 |
| Smiles: | CC(Nc1ccc(cc1)NC(c1c(C)n(c2ccc3c(c2)c(c2ccccc2)on3)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8047 |
| logD: | 3.8046 |
| logSw: | -4.1284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.918 |
| InChI Key: | VFPUKXNTNNJJRE-UHFFFAOYSA-N |