methyl 2,4-dioxo-3-(6-oxo-6-{[(pyridin-2-yl)methyl]amino}hexyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2,4-dioxo-3-(6-oxo-6-{[(pyridin-2-yl)methyl]amino}hexyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 2,4-dioxo-3-(6-oxo-6-{[(pyridin-2-yl)methyl]amino}hexyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2513 |
| Compound Name: | methyl 2,4-dioxo-3-(6-oxo-6-{[(pyridin-2-yl)methyl]amino}hexyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C22 H24 N4 O5 |
| Smiles: | COC(c1ccc2C(N(CCCCCC(NCc3ccccn3)=O)C(Nc2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1729 |
| logD: | 2.1697 |
| logSw: | -3.0814 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.647 |
| InChI Key: | WXWXPVWQBACTPZ-UHFFFAOYSA-N |