5-bromo-6'-chloro-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Chemical Structure Depiction of
5-bromo-6'-chloro-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
5-bromo-6'-chloro-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Compound characteristics
| Compound ID: | Y021-1902 |
| Compound Name: | 5-bromo-6'-chloro-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one |
| Molecular Weight: | 402.68 |
| Molecular Formula: | C18 H13 Br Cl N3 O |
| Smiles: | C1CNC2(C(Nc3ccc(cc23)[Br])=O)c2c1c1cc(ccc1[nH]2)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2206 |
| logD: | 4.1421 |
| logSw: | -4.5338 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 48.015 |
| InChI Key: | XSOBSQCNNGDVAV-SFHVURJKSA-N |