10a-[2-(3-bromophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Chemical Structure Depiction of
10a-[2-(3-bromophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
10a-[2-(3-bromophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Compound characteristics
| Compound ID: | 8010-7216 |
| Compound Name: | 10a-[2-(3-bromophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one |
| Molecular Weight: | 397.31 |
| Molecular Formula: | C21 H21 Br N2 O |
| Smiles: | CC1(C)c2ccccc2N2CCC(NC12/C=C/c1cccc(c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2109 |
| logD: | 5.2109 |
| logSw: | -5.0104 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.3329 |
| InChI Key: | GXLPEZRILPACRN-OAQYLSRUSA-N |