N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0079 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 592.61 |
| Molecular Formula: | C33 H28 N4 O7 |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N(C(c2ccc(cc12)C(NCc1ccc2c(c1)OCO2)=O)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0035 |
| logD: | 4.0035 |
| logSw: | -4.1731 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.457 |
| InChI Key: | UKZUVBOBQKBNPL-UHFFFAOYSA-N |