{1-[4-(difluoromethoxy)phenyl]-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(3-iodophenyl)methanone
Chemical Structure Depiction of
{1-[4-(difluoromethoxy)phenyl]-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(3-iodophenyl)methanone
{1-[4-(difluoromethoxy)phenyl]-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(3-iodophenyl)methanone
Compound characteristics
| Compound ID: | V006-1028 |
| Compound Name: | {1-[4-(difluoromethoxy)phenyl]-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl}(3-iodophenyl)methanone |
| Molecular Weight: | 574.37 |
| Molecular Formula: | C26 H21 F2 I N2 O3 |
| Smiles: | COc1ccc2c(c1)c1CCN(C(c3ccc(cc3)OC(F)F)c1[nH]2)C(c1cccc(c1)I)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3826 |
| logD: | 6.3826 |
| logSw: | -5.7922 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.22 |
| InChI Key: | BUUKUSUHXRVZNI-XMMPIXPASA-N |