1-[4-(3-methyl-1H-pyrazole-1-sulfonyl)-2-nitrophenyl]pyrrolidin-2-one
Chemical Structure Depiction of
1-[4-(3-methyl-1H-pyrazole-1-sulfonyl)-2-nitrophenyl]pyrrolidin-2-one
1-[4-(3-methyl-1H-pyrazole-1-sulfonyl)-2-nitrophenyl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | 8009-4538 |
| Compound Name: | 1-[4-(3-methyl-1H-pyrazole-1-sulfonyl)-2-nitrophenyl]pyrrolidin-2-one |
| Molecular Weight: | 350.35 |
| Molecular Formula: | C14 H14 N4 O5 S |
| Smiles: | Cc1ccn(n1)S(c1ccc(c(c1)[N+]([O-])=O)N1CCCC1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2335 |
| logD: | 1.2335 |
| logSw: | -2.3901 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.242 |
| InChI Key: | ZZNLQQDNPVBWQI-UHFFFAOYSA-N |