1-(3-phenyl-2,1-benzoxazol-5-yl)-N-(2-phenylethyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(3-phenyl-2,1-benzoxazol-5-yl)-N-(2-phenylethyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
1-(3-phenyl-2,1-benzoxazol-5-yl)-N-(2-phenylethyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D545-0171 |
| Compound Name: | 1-(3-phenyl-2,1-benzoxazol-5-yl)-N-(2-phenylethyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C27 H25 N5 O2 |
| Smiles: | CCCc1c(C(NCCc2ccccc2)=O)nnn1c1ccc2c(c1)c(c1ccccc1)on2 |
| Stereo: | ACHIRAL |
| logP: | 5.1498 |
| logD: | 5.1498 |
| logSw: | -5.1742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.33 |
| InChI Key: | ZVWZEHMTMIYAQI-UHFFFAOYSA-N |