1-(4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-(4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
1-(4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | 8015-2387 |
| Compound Name: | 1-(4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}phenyl)pyrrolidin-2-one |
| Molecular Weight: | 498.48 |
| Molecular Formula: | C21 H21 F3 N4 O5 S |
| Smiles: | C1CC(N(C1)c1ccc(cc1)S(N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5632 |
| logD: | 3.5632 |
| logSw: | -4.159 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.806 |
| InChI Key: | LDTVJTOVPUFLCZ-UHFFFAOYSA-N |