AC1O6816
4-[[6-methyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid
Also Known As: 4-{[6-methyl-3-(morpholin-4-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid|3-{N-[6-methyl-3-(morpholin-4-ylcarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2 -yl]carbamoyl}propanoic acid|4-((6-methyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-4-oxobutanoic acid|4-[[6-methyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid
| Molecular Formula | C18H24N2O5S |
|---|---|
| Molecular Weight | 380.1406 g/mol |
| LogP | 2.1486 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.1406 |
| Monoisotopic Mass | 380.1406 |
| Heavy Atoms | 26 |
| Complexity | 708.67975 |
Chemical Identifiers
| CAS Number | 886515-75-9 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N3CCOCC3)NC(=O)CCC(=O)O |
Product Overview
AC1O6816 (CAS 886515-75-9), with molecular formula C18H24N2O5S and molecular weight 380.1406 g/mol. IUPAC: 4-[[6-methyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid.
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