methyl 2-{2-[3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetamido}benzoate
methyl 2-{2-[3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | C260-1214 |
| Compound Name: | methyl 2-{2-[3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-2,4-dioxo-3,4-dihydroquinazolin-1(2H)-yl]acetamido}benzoate |
| Molecular Weight: | 544.56 |
| Molecular Formula: | C29 H28 N4 O7 |
| Smiles: | COC(c1ccccc1NC(CN1C(N(CCC(NCc2ccccc2OC)=O)C(c2ccccc12)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8636 |
| logD: | 2.8512 |
| logSw: | -3.4622 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.973 |
| InChI Key: | XCRIEMYVUPSDNG-UHFFFAOYSA-N |