2'-acetyl-5-bromo-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Chemical Structure Depiction of
2'-acetyl-5-bromo-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
2'-acetyl-5-bromo-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Compound characteristics
| Compound ID: | Y021-2021 |
| Compound Name: | 2'-acetyl-5-bromo-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one |
| Molecular Weight: | 410.27 |
| Molecular Formula: | C20 H16 Br N3 O2 |
| Smiles: | CC(N1CCc2c3ccccc3[nH]c2C12C(Nc1ccc(cc12)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4711 |
| logD: | 3.4593 |
| logSw: | -3.9261 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.488 |
| InChI Key: | LTXQVCNJSCAUTA-FQEVSTJZSA-N |