ethyl 3-{[5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methoxybenzene-1-sulfonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methoxybenzene-1-sulfonyl]amino}benzoate
ethyl 3-{[5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methoxybenzene-1-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | M039-0253 |
| Compound Name: | ethyl 3-{[5-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-2-methoxybenzene-1-sulfonyl]amino}benzoate |
| Molecular Weight: | 480.54 |
| Molecular Formula: | C24 H24 N4 O5 S |
| Smiles: | [H]c1c(c2ccc(c(c2)S(Nc2cccc(c2)C(=O)OCC)(=O)=O)OC)c2nc(C)cc(C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3072 |
| logD: | 4.1034 |
| logSw: | -4.1926 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.979 |
| InChI Key: | VCBWMBXFYASPHJ-UHFFFAOYSA-N |