methyl [(5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
methyl [(5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D724-0318 |
| Compound Name: | methyl [(5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C16 H15 N3 O2 S |
| Smiles: | Cc1cc(n2c(c(cn2)c2ccccc2)n1)SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8886 |
| logD: | 2.8843 |
| logSw: | -3.211 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.774 |
| InChI Key: | IYINHFSITQMUFK-UHFFFAOYSA-N |