(9-benzyl-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetic acid
Chemical Structure Depiction of
(9-benzyl-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetic acid
(9-benzyl-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetic acid
Compound characteristics
| Compound ID: | 8255-1210 |
| Compound Name: | (9-benzyl-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetic acid |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C18 H19 N5 O4 |
| Smiles: | CN1C(N(CC(O)=O)C(c2c1nc1N(CCCn12)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6189 |
| logD: | -3.2575 |
| logSw: | -1.245 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.884 |
| InChI Key: | SWGCMSUIHBIEJK-UHFFFAOYSA-N |