[9-(3-chloro-2-methylphenyl)-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-(3-chloro-2-methylphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetic acid
[9-(3-chloro-2-methylphenyl)-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: | 8255-1208 |
| Compound Name: | [9-(3-chloro-2-methylphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetic acid |
| Molecular Weight: | 403.82 |
| Molecular Formula: | C18 H18 Cl N5 O4 |
| Smiles: | Cc1c(cccc1[Cl])N1CCCn2c3C(N(CC(O)=O)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8181 |
| logD: | -2.0583 |
| logSw: | -2.447 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.137 |
| InChI Key: | DMAZNBYBTSMTLM-UHFFFAOYSA-N |