5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-N-[3-(1H-tetrazol-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-N-[3-(1H-tetrazol-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-N-[3-(1H-tetrazol-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D443-1864 |
| Compound Name: | 5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-N-[3-(1H-tetrazol-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 463.46 |
| Molecular Formula: | C24 H17 N9 O2 |
| Smiles: | Cc1c(C(Nc2cccc(c2)n2cnnn2)=O)nnn1c1ccc2c(c1)c(c1ccccc1)on2 |
| Stereo: | ACHIRAL |
| logP: | 3.965 |
| logD: | 3.965 |
| logSw: | -4.2331 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.421 |
| InChI Key: | KYALZUJOHWMQMB-UHFFFAOYSA-N |