N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(4-ethylanilino)quinazoline-2-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(4-ethylanilino)quinazoline-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(4-ethylanilino)quinazoline-2-carboxamide
Compound characteristics
| Compound ID: | G582-2967 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(4-ethylanilino)quinazoline-2-carboxamide |
| Molecular Weight: | 465.6 |
| Molecular Formula: | C29 H31 N5 O |
| Smiles: | CCc1ccc(cc1)Nc1c2ccccc2nc(C(NCCCN2CCc3ccccc3C2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8241 |
| logD: | 4.6743 |
| logSw: | -5.676 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.976 |
| InChI Key: | IBLROJQUABLWPJ-UHFFFAOYSA-N |