N,N-diethyl-4-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylpentan-1-aminium
Chemical Structure Depiction of
N,N-diethyl-4-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylpentan-1-aminium
N,N-diethyl-4-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylpentan-1-aminium
Compound characteristics
| Compound ID: | K844-1175 |
| Compound Name: | N,N-diethyl-4-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylpentan-1-aminium |
| Molecular Weight: | 491.41 |
| Molecular Formula: | C20 H34 N3 O3 |
| Salt: | I- |
| Smiles: | CC[N+](C)(CC)CCCC(C)NC(C1=C(C2CCCCC=2NC1=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3684 |
| logD: | -0.8998 |
| logSw: | -1.8238 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.475 |
| InChI Key: | CMQDOTQXWRFUNB-AWEZNQCLSA-O |