2-({6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-propylacetamide
Chemical Structure Depiction of
2-({6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-propylacetamide
2-({6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-propylacetamide
Compound characteristics
| Compound ID: | C200-6691 |
| Compound Name: | 2-({6-[(4-chlorophenyl)methyl]-1-ethyl-3-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl}sulfanyl)-N-propylacetamide |
| Molecular Weight: | 433.96 |
| Molecular Formula: | C20 H24 Cl N5 O2 S |
| Smiles: | CCCNC(CSC1=Nc2c(C)nn(CC)c2C(N1Cc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5967 |
| logD: | 2.5967 |
| logSw: | -3.3613 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.022 |
| InChI Key: | AYWUUXYYCOKYPI-UHFFFAOYSA-N |