(4-tert-butylphenyl){4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4-tert-butylphenyl){4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone
(4-tert-butylphenyl){4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | 5820-0763 |
| Compound Name: | (4-tert-butylphenyl){4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 498.63 |
| Molecular Formula: | C30 H34 N4 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N1CCN(CC1)c1ccc(c(c1)N1CCc2ccccc2C1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.195 |
| logD: | 6.195 |
| logSw: | -5.4924 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.041 |
| InChI Key: | ZBAWBHMXEZZAGU-UHFFFAOYSA-N |