9-hydroxy-2-methyl-3-(2-{8-methyl-5-[2-(pyridin-2-yl)ethyl]-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl}ethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
9-hydroxy-2-methyl-3-(2-{8-methyl-5-[2-(pyridin-2-yl)ethyl]-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl}ethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
9-hydroxy-2-methyl-3-(2-{8-methyl-5-[2-(pyridin-2-yl)ethyl]-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl}ethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | H025-1006C |
| Compound Name: | 9-hydroxy-2-methyl-3-(2-{8-methyl-5-[2-(pyridin-2-yl)ethyl]-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl}ethyl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 493.61 |
| Molecular Formula: | C30 H31 N5 O2 |
| Smiles: | CC1=C(CCN2CCc3c(C2)c2cc(C)ccc2n3CCc2ccccn2)C(N2C=CC=C(C2=N1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3948 |
| logD: | -0.8146 |
| logSw: | -3.6284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.081 |
| InChI Key: | WZSAWHDZMZIGJS-UHFFFAOYSA-N |