N-[2-(cyclohex-1-en-1-yl)ethyl]-1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0597 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}piperidine-4-carboxamide |
| Molecular Weight: | 450.65 |
| Molecular Formula: | C26 H34 N4 O S |
| Smiles: | Cc1ccc(C)c(c1)Sc1cc(ncn1)N1CCC(CC1)C(NCCC1CCCCC=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9541 |
| logD: | 5.9537 |
| logSw: | -5.3391 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.501 |
| InChI Key: | XRDCPGICOBLDFC-UHFFFAOYSA-N |