N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1018 |
| Compound Name: | N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C25 H34 N4 O3 |
| Smiles: | CN1CCC(CC1)OCCCNC(C1CCC2=C(CC1)N=C(c1ccccc1)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1425 |
| logD: | 1.1425 |
| logSw: | -2.0448 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.048 |
| InChI Key: | YHBJJRITXKOSTN-LJQANCHMSA-N |