methyl {2-[N'-(naphthalen-1-yl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate
Chemical Structure Depiction of
methyl {2-[N'-(naphthalen-1-yl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate
methyl {2-[N'-(naphthalen-1-yl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate
Compound characteristics
| Compound ID: | Y021-1680 |
| Compound Name: | methyl {2-[N'-(naphthalen-1-yl)carbamimidamido]-6-oxo-1,6-dihydropyrimidin-4-yl}acetate |
| Molecular Weight: | 351.36 |
| Molecular Formula: | C18 H17 N5 O3 |
| Smiles: | COC(CC1=CC(NC(NC(=N)Nc2cccc3ccccc23)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7379 |
| logD: | 0.9822 |
| logSw: | -2.4718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 92.267 |
| InChI Key: | XYMMOJDWIDWXDS-UHFFFAOYSA-N |