5-bromo-6'-chloro-1-methyl-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Chemical Structure Depiction of
5-bromo-6'-chloro-1-methyl-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
5-bromo-6'-chloro-1-methyl-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one
Compound characteristics
| Compound ID: | D718-0465 |
| Compound Name: | 5-bromo-6'-chloro-1-methyl-2',3',4',9'-tetrahydrospiro[indole-3,1'-pyrido[3,4-b]indol]-2(1H)-one |
| Molecular Weight: | 416.7 |
| Molecular Formula: | C19 H15 Br Cl N3 O |
| Smiles: | CN1C(C2(c3cc(ccc13)[Br])c1c(CCN2)c2cc(ccc2[nH]1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1076 |
| logD: | 4.0943 |
| logSw: | -4.4805 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.277 |
| InChI Key: | BZHLYMGLKOUBBH-IBGZPJMESA-N |