ethyl 2-[3-(3-chlorophenyl)-1-(2-methoxyethyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanoate
Chemical Structure Depiction of
ethyl 2-[3-(3-chlorophenyl)-1-(2-methoxyethyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanoate
ethyl 2-[3-(3-chlorophenyl)-1-(2-methoxyethyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanoate
Compound characteristics
Compound ID: | V012-7703 |
Compound Name: | ethyl 2-[3-(3-chlorophenyl)-1-(2-methoxyethyl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanoate |
Molecular Weight: | 420.85 |
Molecular Formula: | C19 H21 Cl N4 O5 |
Smiles: | CCOC(C(C)n1cnc2c1C(N(CCOC)C(N2c1cccc(c1)[Cl])=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.1848 |
logD: | 2.1848 |
logSw: | -2.8375 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 72.304 |
InChI Key: | YGGWBBLCVVWIOS-LBPRGKRZSA-N |