N-(4-chlorophenyl)-2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(4-chlorophenyl)-2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G786-1726 |
| Compound Name: | N-(4-chlorophenyl)-2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 461.97 |
| Molecular Formula: | C21 H24 Cl N5 O3 S |
| Smiles: | CC(C)(C)Cc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7947 |
| logD: | 4.7946 |
| logSw: | -5.0894 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.195 |
| InChI Key: | ZZEHAOWMKIKVPD-UHFFFAOYSA-N |