N-(3,5-dimethoxyphenyl)-1-[(3-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-1-[(3-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-(3,5-dimethoxyphenyl)-1-[(3-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2087 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-1-[(3-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C22 H20 F N5 O3 |
| Smiles: | COc1cc(cc(c1)OC)NC(c1c(n2cccc2)n(Cc2cccc(c2)F)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0308 |
| logD: | 4.0307 |
| logSw: | -4.2233 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.916 |
| InChI Key: | SLERCTJCQZJJBQ-UHFFFAOYSA-N |