3-[2-{2-[3-(2-hydroxyethyl)-5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene]ethylidene}-1,3-benzoxazol-3(2H)-yl]propanoic acid
					Chemical Structure Depiction of
3-[2-{2-[3-(2-hydroxyethyl)-5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene]ethylidene}-1,3-benzoxazol-3(2H)-yl]propanoic acid
			3-[2-{2-[3-(2-hydroxyethyl)-5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene]ethylidene}-1,3-benzoxazol-3(2H)-yl]propanoic acid
Compound characteristics
| Compound ID: | 4311-1865 | 
| Compound Name: | 3-[2-{2-[3-(2-hydroxyethyl)-5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene]ethylidene}-1,3-benzoxazol-3(2H)-yl]propanoic acid | 
| Molecular Weight: | 417.48 | 
| Molecular Formula: | C20 H23 N3 O5 S | 
| Smiles: | CCCN1C(\C(=C\C=C2/N(CCC(O)=O)c3ccccc3O2)N(CCO)C1=S)=O | 
| Stereo: | ACHIRAL | 
| logP: | 1.2709 | 
| logD: | -1.236 | 
| logSw: | -1.9367 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 72.368 | 
| InChI Key: | MLOUQZCXEHRJSD-UHFFFAOYSA-N | 
 
				 
				