1-ethyl-4-methyl-5-{4-nitro-2-[(propan-2-yl)sulfamoyl]phenoxy}-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-ethyl-4-methyl-5-{4-nitro-2-[(propan-2-yl)sulfamoyl]phenoxy}-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
1-ethyl-4-methyl-5-{4-nitro-2-[(propan-2-yl)sulfamoyl]phenoxy}-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V023-4040 |
| Compound Name: | 1-ethyl-4-methyl-5-{4-nitro-2-[(propan-2-yl)sulfamoyl]phenoxy}-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 495.55 |
| Molecular Formula: | C21 H29 N5 O7 S |
| Salt: | not_available |
| Smiles: | CCn1c(c(C)c(C(NCC2CCCO2)=O)n1)Oc1ccc(cc1S(NC(C)C)(=O)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8894 |
| logD: | 1.8892 |
| logSw: | -2.7508 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 128.727 |
| InChI Key: | BJADDGWMHBGQAP-MRXNPFEDSA-N |