AC1MOPSY
6-[[4-(2,5-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
Also Known As: AK-968/40707225|6-{[4-(2,5-dimethylphenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid|6-({[4-(2,5-dimethylphenyl)-3-(ethoxycarbonyl)-5-methylthien-2-yl]amino}carbonyl)cyclohex-3-ene-1-carboxylic acid|6-[[4-(2,5-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid|6-((4-(2,5-dimethylphenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl)carbamoyl)cyclohex-3-enecarboxylic acid
| Molecular Formula | C24H27NO5S |
|---|---|
| Molecular Weight | 441.16098 g/mol |
| LogP | 5.12256 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.16098 |
| Monoisotopic Mass | 441.16098 |
| Heavy Atoms | 31 |
| Complexity | 1052.4794 |
Chemical Identifiers
| CAS Number | 445002-66-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C2=C(C=CC(=C2)C)C)C)NC(=O)C3CC=CCC3C(=O)O |
Product Overview
AC1MOPSY (CAS 445002-66-4), with molecular formula C24H27NO5S and molecular weight 441.16098 g/mol. IUPAC: 6-[[4-(2,5-dimethylphenyl)-3-ethoxycarbonyl-5-methylthiophen-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid.
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