6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | C200-7268 |
| Compound Name: | 6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-5-sulfanylidene-1,4,5,6-tetrahydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 334.82 |
| Molecular Formula: | C15 H15 Cl N4 O S |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)[Cl])C(Nc2c(C)n1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.411 |
| logD: | 2.4087 |
| logSw: | -3.3404 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.985 |
| InChI Key: | UJEJYUQWMIUGNE-UHFFFAOYSA-N |