2,4-dichloro-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-5-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
2,4-dichloro-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-5-(pyrrolidine-1-sulfonyl)benzamide
2,4-dichloro-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-5-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | Y502-1451 |
| Compound Name: | 2,4-dichloro-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]-5-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 476.34 |
| Molecular Formula: | C17 H19 Cl2 N5 O5 S |
| Smiles: | Cc1cc(nn1CCNC(c1cc(c(cc1[Cl])[Cl])S(N1CCCC1)(=O)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1925 |
| logD: | 2.1923 |
| logSw: | -3.5105 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.594 |
| InChI Key: | RIGYTUSTWNQGTG-UHFFFAOYSA-N |