1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-N-(1,3-thiazol-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-N-(1,3-thiazol-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-N-(1,3-thiazol-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D545-0158 |
| Compound Name: | 1-(3-phenyl-2,1-benzoxazol-5-yl)-5-propyl-N-(1,3-thiazol-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 430.49 |
| Molecular Formula: | C22 H18 N6 O2 S |
| Smiles: | CCCc1c(C(Nc2nccs2)=O)nnn1c1ccc2c(c1)c(c1ccccc1)on2 |
| Stereo: | ACHIRAL |
| logP: | 4.8905 |
| logD: | 4.8717 |
| logSw: | -4.6596 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.645 |
| InChI Key: | OWRXGIMYDOCBKR-UHFFFAOYSA-N |