ethyl 3-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Chemical Structure Depiction of
ethyl 3-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
ethyl 3-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Compound characteristics
Compound ID: | C561-0604 |
Compound Name: | ethyl 3-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate |
Molecular Weight: | 442.52 |
Molecular Formula: | C26 H26 N4 O3 |
Smiles: | CCOC(c1cccc(c1)NC(CCc1c(C)nc2cc(c3ccccc3)nn2c1C)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.066 |
logD: | 5.0578 |
logSw: | -4.6922 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.352 |
InChI Key: | SCIWFXANDDPEKV-UHFFFAOYSA-N |