methyl 3-[6-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[6-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-[6-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2549 |
| Compound Name: | methyl 3-[6-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 508.62 |
| Molecular Formula: | C28 H36 N4 O5 |
| Smiles: | CCN(CCCNC(CCCCCN1C(c2ccc(cc2NC1=O)C(=O)OC)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0727 |
| logD: | 4.0373 |
| logSw: | -4.0022 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.935 |
| InChI Key: | QLBBRNKSVPPMHB-UHFFFAOYSA-N |