8-{6-[3-(azepane-1-sulfonyl)-4-methylphenyl]pyridazin-3-yl}-1,4-dioxa-8-azaspiro[4.5]decane
Chemical Structure Depiction of
8-{6-[3-(azepane-1-sulfonyl)-4-methylphenyl]pyridazin-3-yl}-1,4-dioxa-8-azaspiro[4.5]decane
8-{6-[3-(azepane-1-sulfonyl)-4-methylphenyl]pyridazin-3-yl}-1,4-dioxa-8-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | L285-2112 |
| Compound Name: | 8-{6-[3-(azepane-1-sulfonyl)-4-methylphenyl]pyridazin-3-yl}-1,4-dioxa-8-azaspiro[4.5]decane |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C24 H32 N4 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCCCCC1)(=O)=O)c1ccc(nn1)N1CCC2(CC1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.6686 |
| logD: | 3.6676 |
| logSw: | -3.8346 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.105 |
| InChI Key: | MZLNDFLOQDRNRH-UHFFFAOYSA-N |