N-(3-chloro-4-methoxyphenyl)-2-{1-ethyl-6-[(furan-2-yl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{1-ethyl-6-[(furan-2-yl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
N-(3-chloro-4-methoxyphenyl)-2-{1-ethyl-6-[(furan-2-yl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
Compound characteristics
| Compound ID: | E961-1218 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{1-ethyl-6-[(furan-2-yl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide |
| Molecular Weight: | 471.9 |
| Molecular Formula: | C22 H22 Cl N5 O5 |
| Smiles: | CCn1c2C(N(Cc3ccco3)C(N(CC(Nc3ccc(c(c3)[Cl])OC)=O)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6847 |
| logD: | 2.6844 |
| logSw: | -3.4072 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.872 |
| InChI Key: | JSLNJPGPTVWWFT-UHFFFAOYSA-N |