diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
					Chemical Structure Depiction of
diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
			diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | K403-0280 | 
| Compound Name: | diethyl 3-methyl-5-[2-({5-[(3-methylbenzamido)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate | 
| Molecular Weight: | 635.76 | 
| Molecular Formula: | C31 H33 N5 O6 S2 | 
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nnc(CNC(c2cccc(C)c2)=O)n1c1cccc(C)c1)=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.9924 | 
| logD: | 3.2084 | 
| logSw: | -4.7132 | 
| Hydrogen bond acceptors count: | 13 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 114.825 | 
| InChI Key: | WQFCOCXVLZSRNG-UHFFFAOYSA-N | 
 
				 
				