2'-acetyl-5-bromo-1-(3-methylbutyl)-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Chemical Structure Depiction of
2'-acetyl-5-bromo-1-(3-methylbutyl)-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
2'-acetyl-5-bromo-1-(3-methylbutyl)-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Compound characteristics
| Compound ID: | Y020-2221 |
| Compound Name: | 2'-acetyl-5-bromo-1-(3-methylbutyl)-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one |
| Molecular Weight: | 480.4 |
| Molecular Formula: | C25 H26 Br N3 O2 |
| Smiles: | CC(C)CCN1C(C2(c3cc(ccc13)[Br])c1c(CCN2C(C)=O)c2ccccc2[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2164 |
| logD: | 5.2164 |
| logSw: | -5.1943 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.964 |
| InChI Key: | BPYWOABFYOEPBG-VWLOTQADSA-N |