5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-7-(3-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-7-(3-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-7-(3-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G786-1828 |
| Compound Name: | 5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-7-(3-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C25 H23 N5 O3 S |
| Smiles: | Cc1cccc(c1)c1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(N1CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0211 |
| logD: | 5.0211 |
| logSw: | -4.7367 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.207 |
| InChI Key: | JLBSRORCNALXSU-UHFFFAOYSA-N |