6-(azepane-1-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
					Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
			6-(azepane-1-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-2708 | 
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide | 
| Molecular Weight: | 537.63 | 
| Molecular Formula: | C28 H31 N3 O6 S | 
| Smiles: | C=CCN1C=C(C(c2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)C(NCC1COc2ccccc2O1)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 3.4865 | 
| logD: | 3.4865 | 
| logSw: | -4.0109 | 
| Hydrogen bond acceptors count: | 11 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 87.947 | 
| InChI Key: | JSXSUXQSBCJXKQ-FQEVSTJZSA-N | 
 
				 
				