ethyl 3-[2-anilino-5-methyl-3-(4-methylbenzene-1-sulfonyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoate
Chemical Structure Depiction of
ethyl 3-[2-anilino-5-methyl-3-(4-methylbenzene-1-sulfonyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoate
ethyl 3-[2-anilino-5-methyl-3-(4-methylbenzene-1-sulfonyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoate
Compound characteristics
| Compound ID: | C201-0614 |
| Compound Name: | ethyl 3-[2-anilino-5-methyl-3-(4-methylbenzene-1-sulfonyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl]propanoate |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | CCOC(CCC1=C(C)Nc2c(c(Nc3ccccc3)nn2C1=O)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8389 |
| logD: | 3.8329 |
| logSw: | -3.8505 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.626 |
| InChI Key: | OOBOAZHXSXSKHP-UHFFFAOYSA-N |