5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-{4-[(propan-2-yl)oxy]phenyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-{4-[(propan-2-yl)oxy]phenyl}-1H-pyrazole-3-carboxamide
5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-{4-[(propan-2-yl)oxy]phenyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D627-0329 |
| Compound Name: | 5-(3,4-dimethylphenyl)-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-{4-[(propan-2-yl)oxy]phenyl}-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 467.59 |
| Molecular Formula: | C25 H29 N3 O4 S |
| Smiles: | CC(C)Oc1ccc(cc1)NC(c1cc(c2ccc(C)c(C)c2)n(C2CCS(C2)(=O)=O)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2928 |
| logD: | 4.2928 |
| logSw: | -4.2031 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.226 |
| InChI Key: | GDHJHRYWXFSMMN-OAQYLSRUSA-N |