methyl [(5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
methyl [(5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D724-0260 |
| Compound Name: | methyl [(5-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]acetate |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | Cc1c(c2ccccc2)c2nc(cc(n2n1)SCC(=O)OC)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.2945 |
| logD: | 4.2812 |
| logSw: | -4.5052 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.32 |
| InChI Key: | HBVUSJKTTXIWSZ-UHFFFAOYSA-N |