1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-5282 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C20 H19 N5 O2 S |
| Smiles: | COc1ccc(Cn2c(c(C(NCc3cccs3)=O)nn2)n2cccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3183 |
| logD: | 3.3183 |
| logSw: | -3.5149 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.712 |
| InChI Key: | PTQQMINVOCMQJR-UHFFFAOYSA-N |