1-(4-methylbenzene-1-sulfonyl)-10b-phenyl-1,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-6(2H)-one
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-10b-phenyl-1,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-6(2H)-one
1-(4-methylbenzene-1-sulfonyl)-10b-phenyl-1,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-6(2H)-one
Compound characteristics
| Compound ID: | 8019-0466 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-10b-phenyl-1,3,4,10b-tetrahydropyrimido[2,1-a]isoindol-6(2H)-one |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C24 H22 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(N1CCCN2C(c3ccccc3C12c1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6646 |
| logD: | 4.6646 |
| logSw: | -4.4072 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.313 |
| InChI Key: | DFKOJKBREONFMU-XMMPIXPASA-N |