4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1174 |
| Compound Name: | 4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one |
| Molecular Weight: | 380.41 |
| Molecular Formula: | C14 H22 F2 N4 O4 S |
| Smiles: | CC(C)CN1CC(CN(CC1=O)S(c1cnn(C(F)F)c1C)(=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.2484 |
| logD: | -0.2484 |
| logSw: | -1.2223 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.365 |
| InChI Key: | TVVNLGSOLHVWJR-NSHDSACASA-N |