ethyl 4-[(7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate
ethyl 4-[(7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | E851-1386 |
| Compound Name: | ethyl 4-[(7,8,9,10-tetrahydro-6H-cyclohepta[e]pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cnn2C3CCCCCC=3C=Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0999 |
| logD: | 4.0633 |
| logSw: | -3.9275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.577 |
| InChI Key: | FCYQGEKQFYTVFE-UHFFFAOYSA-N |