5-[1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(propan-2-yl)pentanamide
Chemical Structure Depiction of
5-[1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(propan-2-yl)pentanamide
5-[1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(propan-2-yl)pentanamide
Compound characteristics
| Compound ID: | F142-0249 |
| Compound Name: | 5-[1-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]-N-(propan-2-yl)pentanamide |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C26 H30 N4 O6 |
| Smiles: | CC(C)NC(CCCCN1C(c2ccccc2N(CC(NCc2ccc3c(c2)OCO3)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8774 |
| logD: | 1.8774 |
| logSw: | -2.9639 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.549 |
| InChI Key: | ZFGOMDJQKXUYTD-UHFFFAOYSA-N |