N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]acrylamide
					Chemical Structure Depiction of
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]acrylamide
			N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]acrylamide
Compound characteristics
| Compound ID: | C508-0266 | 
| Compound Name: | N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-[5-(2-methyl-5-nitrophenyl)-2-furyl]acrylamide | 
| Molecular Weight: | 437.48 | 
| Molecular Formula: | C21 H19 N5 O4 S | 
| Smiles: | CCCCc1nnc(NC(C(=C/c2ccc(c3cc(ccc3C)[N+]([O-])=O)o2)\C#N)=O)s1 | 
| Stereo: | ACHIRAL | 
| logP: | 5.64 | 
| logD: | 3.69 | 
| logSw: | -6.32 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 223.49 | 
| InChI Key: | DAFHMDFLBAQGNQ-UHFFFAOYSA-N | 
 
				 
				