N-[2-(4-chlorophenyl)ethyl]-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-[2-(4-chlorophenyl)ethyl]-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-[2-(4-chlorophenyl)ethyl]-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: | E961-1260 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-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: | 469.93 |
| Molecular Formula: | C23 H24 Cl N5 O4 |
| Smiles: | CCn1c2C(N(Cc3ccco3)C(N(CC(NCCc3ccc(cc3)[Cl])=O)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1212 |
| logD: | 2.1212 |
| logSw: | -3.0414 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.405 |
| InChI Key: | VTDHUHNDYHLVRJ-UHFFFAOYSA-N |