5-amino-1-[(3-bromophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[(3-bromophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[(3-bromophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0812 |
| Compound Name: | 5-amino-1-[(3-bromophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 416.28 |
| Molecular Formula: | C18 H18 Br N5 O2 |
| Smiles: | COc1ccccc1CNC(c1c(N)n(Cc2cccc(c2)[Br])nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5905 |
| logD: | 2.5905 |
| logSw: | -2.9824 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.24 |
| InChI Key: | MZBXXODCYCQVBB-UHFFFAOYSA-N |