2-{[N-(butan-2-yl)(tert-butyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
					Chemical Structure Depiction of
2-{[N-(butan-2-yl)(tert-butyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
			2-{[N-(butan-2-yl)(tert-butyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V030-3529 | 
| Compound Name: | 2-{[N-(butan-2-yl)(tert-butyl)carbamamido]methyl}-5-(diethylamino)phenyl ethanesulfonate | 
| Molecular Weight: | 441.63 | 
| Molecular Formula: | C22 H39 N3 O4 S | 
| Salt: | not_available | 
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(CC)(=O)=O)N(CC)CC)C(NC(C)(C)C)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 4.724 | 
| logD: | 4.7144 | 
| logSw: | -4.4932 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 62.947 | 
| InChI Key: | YXSJZSAMYJSQJM-KRWDZBQOSA-N | 
 
				 
				