9-(2,3-dimethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(2,3-dimethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(2,3-dimethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | D389-1092 |
Compound Name: | 9-(2,3-dimethylphenyl)-1-methyl-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
Molecular Weight: | 365.43 |
Molecular Formula: | C20 H23 N5 O2 |
Smiles: | Cc1cccc(c1C)N1CCCn2c3C(N(CC=C)C(N(C)c3nc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7257 |
logD: | 3.7213 |
logSw: | -3.8998 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 44.732 |
InChI Key: | MJOCWJCHDZAZMA-UHFFFAOYSA-N |