2-[(6-benzyl-1-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N,N-dipropylacetamide
Chemical Structure Depiction of
2-[(6-benzyl-1-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N,N-dipropylacetamide
2-[(6-benzyl-1-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N,N-dipropylacetamide
Compound characteristics
| Compound ID: | C200-4016 |
| Compound Name: | 2-[(6-benzyl-1-methyl-7-oxo-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl]-N,N-dipropylacetamide |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C21 H27 N5 O2 S |
| Smiles: | CCCN(CCC)C(CSC1=Nc2cnn(C)c2C(N1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8705 |
| logD: | 2.8705 |
| logSw: | -3.0575 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.082 |
| InChI Key: | JXKNMFWUBUSHAK-UHFFFAOYSA-N |