2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
Compound characteristics
Compound ID: | Y032-3792 |
Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide |
Molecular Weight: | 421.48 |
Molecular Formula: | C21 H19 N5 O3 S |
Smiles: | CN1C(c2c(ncn2CC(Nc2ccccc2Sc2ccccc2)=O)N(C)C1=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5448 |
logD: | 2.5448 |
logSw: | -2.829 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.141 |
InChI Key: | FOUSSVKRQVGLOJ-UHFFFAOYSA-N |