4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-{[2-(morpholin-4-yl)ethyl]amino}pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-{[2-(morpholin-4-yl)ethyl]amino}pyrimidine-5-carbonitrile
4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-{[2-(morpholin-4-yl)ethyl]amino}pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0106 |
| Compound Name: | 4-(4-tert-butylphenyl)-2-(methylsulfanyl)-6-{[2-(morpholin-4-yl)ethyl]amino}pyrimidine-5-carbonitrile |
| Molecular Weight: | 411.57 |
| Molecular Formula: | C22 H29 N5 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1c(C#N)c(NCCN2CCOCC2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.5925 |
| logD: | 4.5718 |
| logSw: | -4.3573 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.694 |
| InChI Key: | XYTDOBYVWOLITE-UHFFFAOYSA-N |