1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-(3-methoxypropyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-(3-methoxypropyl)piperidine-4-carboxamide
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-(3-methoxypropyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0650 |
| Compound Name: | 1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-(3-methoxypropyl)piperidine-4-carboxamide |
| Molecular Weight: | 414.57 |
| Molecular Formula: | C22 H30 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)Sc1cc(ncn1)N1CCC(CC1)C(NCCCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3424 |
| logD: | 4.342 |
| logSw: | -4.126 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.923 |
| InChI Key: | XCMKMQUHMOTNFH-UHFFFAOYSA-N |