N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K221-3271 |
| Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2,4-dioxo-3-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 526.04 |
| Molecular Formula: | C27 H32 Cl N5 O4 |
| Smiles: | C(CNC(c1ccc2C(N(CC3CCCO3)C(Nc2c1)=O)=O)=O)CN1CCN(CC1)c1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6147 |
| logD: | 2.0708 |
| logSw: | -3.7279 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.632 |
| InChI Key: | VIYCUPHTDKMBHY-JOCHJYFZSA-N |