1-butyl-1'-phenyl-1',7'-dihydrospiro[indole-3,6'-pyrazolo[3,4-d]pyrimidine]-2,4'(1H,5'H)-dione
Chemical Structure Depiction of
1-butyl-1'-phenyl-1',7'-dihydrospiro[indole-3,6'-pyrazolo[3,4-d]pyrimidine]-2,4'(1H,5'H)-dione
1-butyl-1'-phenyl-1',7'-dihydrospiro[indole-3,6'-pyrazolo[3,4-d]pyrimidine]-2,4'(1H,5'H)-dione
Compound characteristics
Compound ID: | Y021-0891 |
Compound Name: | 1-butyl-1'-phenyl-1',7'-dihydrospiro[indole-3,6'-pyrazolo[3,4-d]pyrimidine]-2,4'(1H,5'H)-dione |
Molecular Weight: | 387.44 |
Molecular Formula: | C22 H21 N5 O2 |
Smiles: | CCCCN1C(C2(c3ccccc13)NC(c1cnn(c3ccccc3)c1N2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.66 |
logD: | 3.6598 |
logSw: | -3.7895 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.852 |
InChI Key: | LJWTYBOTTBFATI-QFIPXVFZSA-N |