5-(benzylsulfanyl)-6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Chemical Structure Depiction of
5-(benzylsulfanyl)-6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
5-(benzylsulfanyl)-6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | E960-0982 |
| Compound Name: | 5-(benzylsulfanyl)-6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C22 H21 Cl N4 O S |
| Smiles: | CCn1c2C(N(Cc3ccc(cc3)[Cl])C(=Nc2c(C)n1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.173 |
| logD: | 4.173 |
| logSw: | -4.5261 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.438 |
| InChI Key: | ABQVXXNKXCLWNB-UHFFFAOYSA-N |