7-(3-methoxyphenyl)-1,3-dimethyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(3-methoxyphenyl)-1,3-dimethyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(3-methoxyphenyl)-1,3-dimethyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G786-1858 |
| Compound Name: | 7-(3-methoxyphenyl)-1,3-dimethyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C21 H23 N5 O5 S |
| Smiles: | CN1C(c2c(nc(c3cccc(c3)OC)nc2SCC(N2CCOCC2)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7173 |
| logD: | 2.7173 |
| logSw: | -3.0429 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.629 |
| InChI Key: | IRNRKOOOVAFKPW-UHFFFAOYSA-N |