8-{3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazole-4-sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane--hydrogen chloride (1/1)
Chemical Structure Depiction of
8-{3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazole-4-sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane--hydrogen chloride (1/1)
8-{3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazole-4-sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | M348-0319 |
| Compound Name: | 8-{3,5-dimethyl-1-[6-(4-methylphenyl)pyridazin-3-yl]-1H-pyrazole-4-sulfonyl}-1,4-dioxa-8-azaspiro[4.5]decane--hydrogen chloride (1/1) |
| Molecular Weight: | 506.02 |
| Molecular Formula: | C23 H27 N5 O4 S |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)n1c(C)c(c(C)n1)S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.539 |
| logD: | 2.4826 |
| logSw: | -2.5784 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.739 |
| InChI Key: | JLMAGKGIECXGGW-UHFFFAOYSA-N |