N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide
Compound characteristics
| Compound ID: | L462-0373 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide |
| Molecular Weight: | 370.36 |
| Molecular Formula: | C18 H18 N4 O5 |
| Smiles: | CN1C(c2ccn(CC(NCc3ccc4c(c3)OCO4)=O)c2N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4554 |
| logD: | 1.4554 |
| logSw: | -2.5278 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.271 |
| InChI Key: | XVQWDACEFDQMJC-UHFFFAOYSA-N |