N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)acetamide
Compound characteristics
| Compound ID: | F462-0070 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)acetamide |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C23 H19 N5 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(N(Cc2ccccc2)C(c2c1nccn2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2251 |
| logD: | 2.2251 |
| logSw: | -2.8058 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.094 |
| InChI Key: | MWKNXCPIMQTVQD-UHFFFAOYSA-N |