N-(2-methoxyethyl)-2-{[4-methyl-1-(propan-2-yl)-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-2-{[4-methyl-1-(propan-2-yl)-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
N-(2-methoxyethyl)-2-{[4-methyl-1-(propan-2-yl)-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-7272 |
| Compound Name: | N-(2-methoxyethyl)-2-{[4-methyl-1-(propan-2-yl)-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 495.55 |
| Molecular Formula: | C21 H29 N5 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)n1c(c(C)c(C(N2CCCC2)=O)n1)Oc1ccc(cc1S(NCCOC)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5669 |
| logD: | 2.5668 |
| logSw: | -3.1036 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 122.414 |
| InChI Key: | ZZMMTJCXGBBDKF-UHFFFAOYSA-N |