N-butyl-2-{1-ethyl-6-[(4-methoxyphenyl)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-butyl-2-{1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
N-butyl-2-{1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
Compound characteristics
| Compound ID: | C200-5965 |
| Compound Name: | N-butyl-2-{1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5,7-dioxo-1,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H29 N5 O4 |
| Smiles: | CCCCNC(CN1C(N(Cc2ccc(cc2)OC)C(c2c1c(C)nn2CC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1344 |
| logD: | 2.1344 |
| logSw: | -2.7237 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.471 |
| InChI Key: | TVBVGMSBHZSHKY-UHFFFAOYSA-N |