5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
Compound ID: | D434-0838 |
Compound Name: | 5-{[2-(4-methoxyphenyl)ethyl]amino}-2-[4-(4-methylpiperidine-1-sulfonyl)phenyl]-1,3-oxazole-4-carbonitrile |
Molecular Weight: | 480.59 |
Molecular Formula: | C25 H28 N4 O4 S |
Smiles: | CC1CCN(CC1)S(c1ccc(cc1)c1nc(C#N)c(NCCc2ccc(cc2)OC)o1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0702 |
logD: | 4.0702 |
logSw: | -4.1289 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.374 |
InChI Key: | JZVHHNOZEVDDGJ-UHFFFAOYSA-N |