2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline
2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 6485-2797 |
| Compound Name: | 2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 370.43 |
| Molecular Formula: | C20 H23 F N4 O2 |
| Smiles: | CN1CCN(CC1)c1cc(c(cc1[N+]([O-])=O)F)N1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.5577 |
| logD: | 3.0979 |
| logSw: | -3.8636 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.761 |
| InChI Key: | HIRFJJHUBGHUDC-UHFFFAOYSA-N |