1-[3-(4-bromophenyl)-2,1-benzoxazol-5-yl]-N-(2-hydroxyethyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[3-(4-bromophenyl)-2,1-benzoxazol-5-yl]-N-(2-hydroxyethyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
1-[3-(4-bromophenyl)-2,1-benzoxazol-5-yl]-N-(2-hydroxyethyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D443-2019 |
| Compound Name: | 1-[3-(4-bromophenyl)-2,1-benzoxazol-5-yl]-N-(2-hydroxyethyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 442.27 |
| Molecular Formula: | C19 H16 Br N5 O3 |
| Smiles: | Cc1c(C(NCCO)=O)nnn1c1ccc2c(c1)c(c1ccc(cc1)[Br])on2 |
| Stereo: | ACHIRAL |
| logP: | 2.9212 |
| logD: | 2.9212 |
| logSw: | -3.1957 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.747 |
| InChI Key: | PFYBXTAVNUJTRJ-UHFFFAOYSA-N |