methyl 2-{2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl]acetamido}benzoate
methyl 2-{2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | G420-0038 |
| Compound Name: | methyl 2-{2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C22 H18 N4 O3 S |
| Smiles: | COC(c1ccccc1NC(CSc1c2cc(c3ccccc3)nn2ccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4624 |
| logD: | 3.4469 |
| logSw: | -3.8598 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.374 |
| InChI Key: | OCSOKXDDLBLWLA-UHFFFAOYSA-N |