AC1OZ380
methyl 2-[[2-(2-aminoethylamino)-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: methyl 2-({[(2-aminoethyl)amino](oxo)acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|methyl 2-(2-((2-aminoethyl)amino)-2-oxoacetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|methyl 2-[[2-(2-aminoethylamino)-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|Methyl 3-[(2-aminoethylcarbamoylformyl)amino]-4-thiabicyclo[3.3.0]octa-2,9-diene-2-carboxylate
| Molecular Formula | C13H17N3O4S |
|---|---|
| Molecular Weight | 311.09396 g/mol |
| LogP | 0.0368 |
| Topological Polar Surface Area | 110.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.09396 |
| Monoisotopic Mass | 311.09396 |
| Heavy Atoms | 21 |
| Complexity | 582.2167 |
Chemical Identifiers
| CAS Number | 905014-52-0 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCC2)NC(=O)C(=O)NCCN |
Product Overview
AC1OZ380 (CAS 905014-52-0), with molecular formula C13H17N3O4S and molecular weight 311.09396 g/mol. IUPAC: methyl 2-[[2-(2-aminoethylamino)-2-oxoacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
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