8-(1-ethyl-1H-pyrazole-4-sulfonyl)-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
Chemical Structure Depiction of
8-(1-ethyl-1H-pyrazole-4-sulfonyl)-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
8-(1-ethyl-1H-pyrazole-4-sulfonyl)-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione
Compound characteristics
Compound ID: | S588-0786 |
Compound Name: | 8-(1-ethyl-1H-pyrazole-4-sulfonyl)-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-1,3-dione |
Molecular Weight: | 422.52 |
Molecular Formula: | C18 H22 N4 O4 S2 |
Smiles: | CCn1cc(cn1)S(N1CCC2(CC1)N(C(CS2=O)=O)c1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.4798 |
logD: | 0.4798 |
logSw: | -1.9451 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 77.262 |
InChI Key: | MUQDTRTXKFQZGR-UHFFFAOYSA-N |