1-[(3-fluorophenyl)methyl]-N-(3-methoxyphenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(3-fluorophenyl)methyl]-N-(3-methoxyphenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(3-fluorophenyl)methyl]-N-(3-methoxyphenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2082 |
| Compound Name: | 1-[(3-fluorophenyl)methyl]-N-(3-methoxyphenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 391.4 |
| Molecular Formula: | C21 H18 F N5 O2 |
| Smiles: | COc1cccc(c1)NC(c1c(n2cccc2)n(Cc2cccc(c2)F)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9582 |
| logD: | 3.9582 |
| logSw: | -4.1587 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.372 |
| InChI Key: | VBPOZWMNXAIABE-UHFFFAOYSA-N |