1-(3-fluorophenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(3-fluorophenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
1-(3-fluorophenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V027-4059 |
| Compound Name: | 1-(3-fluorophenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 580.59 |
| Molecular Formula: | C27 H25 F N6 O6 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(NCc2cccnc2)=O)nn(c2cccc(c2)F)c1Oc1ccc(cc1S(N1CCCC1)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5612 |
| logD: | 3.5611 |
| logSw: | -3.6488 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.59 |
| InChI Key: | DTJYKEBDWXQWIL-UHFFFAOYSA-N |