3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K221-3460 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 503.51 |
| Molecular Formula: | C27 H25 N3 O7 |
| Smiles: | COc1ccc(CCNC(c2ccc3C(N(Cc4ccc5c(c4)OCO5)C(Nc3c2)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9827 |
| logD: | 2.9821 |
| logSw: | -3.4505 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.111 |
| InChI Key: | HIPPDLXRUIMSFG-UHFFFAOYSA-N |