4-methyl-2-(methylsulfanyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-methyl-2-(methylsulfanyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide
4-methyl-2-(methylsulfanyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0066 |
| Compound Name: | 4-methyl-2-(methylsulfanyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 301.41 |
| Molecular Formula: | C16 H19 N3 O S |
| Smiles: | Cc1c(cnc(n1)SC)C(NCCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4989 |
| logD: | 3.4989 |
| logSw: | -3.7431 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.885 |
| InChI Key: | QQTFZIJPBKKHEF-UHFFFAOYSA-N |