N-{3-[benzyl(methyl)amino]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-{3-[benzyl(methyl)amino]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0496 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 406.55 |
| Molecular Formula: | C23 H26 N4 O S |
| Smiles: | CN(CCCNC(c1cnc(nc1c1ccccc1)SC)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7534 |
| logD: | 2.3123 |
| logSw: | -3.7586 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.901 |
| InChI Key: | OCWKGJDKLNECCU-UHFFFAOYSA-N |