N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1880 |
| Compound Name: | N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-1-(1-methyl-1H-imidazole-4-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 530.69 |
| Molecular Formula: | C26 H38 N6 O4 S |
| Smiles: | Cn1cc(nc1)S(N1CCCC(CCNC(CC1)=O)C(NCCCN1CCCc2ccccc12)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4758 |
| logD: | 0.4199 |
| logSw: | -2.2784 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.783 |
| InChI Key: | QKYZVMLGLNUJAH-QFIPXVFZSA-N |