N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Compound characteristics
| Compound ID: | C260-1790 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide |
| Molecular Weight: | 513.59 |
| Molecular Formula: | C30 H31 N3 O5 |
| Smiles: | Cc1ccc(C)c(CN2C(N(CCCCC(NCc3ccc4c(c3)OCO4)=O)C(c3ccccc23)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7319 |
| logD: | 4.7319 |
| logSw: | -4.342 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.832 |
| InChI Key: | XSSBQSYCOJKWGI-UHFFFAOYSA-N |