methyl 3-[6-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[6-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-[6-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2540 |
| Compound Name: | methyl 3-[6-({3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 570.09 |
| Molecular Formula: | C29 H36 Cl N5 O5 |
| Smiles: | COC(c1ccc2C(N(CCCCCC(NCCCN3CCN(CC3)c3cccc(c3)[Cl])=O)C(Nc2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4336 |
| logD: | 2.8475 |
| logSw: | -3.8617 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.188 |
| InChI Key: | HLRHBFCCADLNDV-UHFFFAOYSA-N |