N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0182 |
| Compound Name: | N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 415.56 |
| Molecular Formula: | C21 H29 N5 O2 S |
| Smiles: | Cc1c(cnc(n1)SC)C(NCCCN1CCN(CC1)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6189 |
| logD: | 2.075 |
| logSw: | -3.0354 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.672 |
| InChI Key: | FSMWNUBQMUDVGY-UHFFFAOYSA-N |