N,N-diethyl-2-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylethan-1-aminium--iodide (1/1)
Chemical Structure Depiction of
N,N-diethyl-2-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylethan-1-aminium--iodide (1/1)
N,N-diethyl-2-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylethan-1-aminium--iodide (1/1)
Compound characteristics
| Compound ID: | K844-1163 |
| Compound Name: | N,N-diethyl-2-[(4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonyl)amino]-N-methylethan-1-aminium--iodide (1/1) |
| Molecular Weight: | 449.33 |
| Molecular Formula: | C17 H28 N3 O3 |
| Salt: | I- |
| Smiles: | CC[N+](C)(CC)CCNC(C1=C(C2CCCCC=2NC1=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6481 |
| logD: | -1.6201 |
| logSw: | -1.2091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.875 |
| InChI Key: | CLZLUJPUIIPLEQ-UHFFFAOYSA-O |