2,4-dichloro-N-{1-[(2-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
2,4-dichloro-N-{1-[(2-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-(pyrrolidine-1-sulfonyl)benzamide
2,4-dichloro-N-{1-[(2-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | Y502-1446 |
| Compound Name: | 2,4-dichloro-N-{1-[(2-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 498.36 |
| Molecular Formula: | C20 H18 Cl2 F N5 O3 S |
| Smiles: | C1CCN(C1)S(c1cc(C(Nc2ncn(Cc3ccccc3F)n2)=O)c(cc1[Cl])[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9413 |
| logD: | 1.8855 |
| logSw: | -4.6544 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.628 |
| InChI Key: | AJUZNNSTBURSIH-UHFFFAOYSA-N |