1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-1040 |
| Compound Name: | 1-[6-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-N-propylpiperidine-4-carboxamide |
| Molecular Weight: | 459.63 |
| Molecular Formula: | C22 H29 N5 O2 S2 |
| Smiles: | CCCNC(C1CCN(CC1)c1cc(ncn1)SCC(Nc1cccc(c1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7694 |
| logD: | 3.7693 |
| logSw: | -3.7045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.729 |
| InChI Key: | ZGOYCNQPYVROJY-UHFFFAOYSA-N |