N-(3,4-dimethylphenyl)-N'-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-N'-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}urea
N-(3,4-dimethylphenyl)-N'-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | C301-8767 |
| Compound Name: | N-(3,4-dimethylphenyl)-N'-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 464.55 |
| Molecular Formula: | C23 H24 N6 O3 S |
| Smiles: | Cc1ccc(cc1C)NC(Nc1ccccc1Sc1nc2c(C(N(C)C(N2C)=O)=O)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8814 |
| logD: | 4.8814 |
| logSw: | -4.5577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.701 |
| InChI Key: | WSJCRXGZOIVRHI-UHFFFAOYSA-N |