3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-ethylhexyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-ethylhexyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-ethylhexyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K221-3431 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-ethylhexyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCCCC(CC)CNC(c1ccc2C(N(Cc3ccc4c(c3)OCO4)C(Nc2c1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2011 |
| logD: | 5.2005 |
| logSw: | -5.1604 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.281 |
| InChI Key: | WWAGCFBYGIHUKQ-INIZCTEOSA-N |