N-(4-methylphenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
N-(4-methylphenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D545-0128 |
| Compound Name: | N-(4-methylphenyl)-1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 437.5 |
| Molecular Formula: | C26 H23 N5 O2 |
| Smiles: | CCCc1c(C(Nc2ccc(C)cc2)=O)nnn1c1ccc2c(c1)c(c1ccccc1)on2 |
| Stereo: | ACHIRAL |
| logP: | 6.0484 |
| logD: | 6.0483 |
| logSw: | -5.4945 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.166 |
| InChI Key: | XZULLSKHJAVYCF-UHFFFAOYSA-N |