1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C200-7269 |
| Compound Name: | 1-ethyl-6-[(4-methoxyphenyl)methyl]-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 330.41 |
| Molecular Formula: | C16 H18 N4 O2 S |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)OC)C(Nc2c(C)n1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7987 |
| logD: | 1.7964 |
| logSw: | -2.5461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.529 |
| InChI Key: | DGQBKTDXDKRXKT-UHFFFAOYSA-N |