ethyl 2-{2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
					Chemical Structure Depiction of
ethyl 2-{2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
			ethyl 2-{2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-7151 | 
| Compound Name: | ethyl 2-{2-[(5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamido}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate | 
| Molecular Weight: | 453.54 | 
| Molecular Formula: | C21 H19 N5 O3 S2 | 
| Smiles: | CCOC(c1c2CCCc2sc1NC(CSc1nc2c(c3ccccc3[nH]2)nn1)=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.3809 | 
| logD: | 1.3092 | 
| logSw: | -3.7549 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 85.519 | 
| InChI Key: | NEGRPJUAHKWJAE-UHFFFAOYSA-N | 
 
				 
				