AC1MEP8S
2-amino-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: BAS 00673078|AB00092108-01|AG-690/11663355|2-amino-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile|2-amino-4-(5-ethyl(2-thienyl))-7,7-dimethyl-5-oxo-4H-6,7,8-trihydrochromene-3- carbonitrile|2-amino-4-(5-ethyl(2-thienyl))-7,7-dimethyl-5-oxo-4H-6,7,8-trihydrochromene-3-carbonitrile|2-amino-4-(5-ethylthien-2-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
| Molecular Formula | C18H20N2O2S |
|---|---|
| Molecular Weight | 328.12454 g/mol |
| LogP | 3.76138 |
| Topological Polar Surface Area | 76.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.12454 |
| Monoisotopic Mass | 328.12454 |
| Heavy Atoms | 23 |
| Complexity | 777.1874 |
Chemical Identifiers
| CAS Number | 329693-55-2 |
|---|---|
| SMILES | CCC1=CC=C(S1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N |
Product Overview
AC1MEP8S (CAS 329693-55-2), with molecular formula C18H20N2O2S and molecular weight 328.12454 g/mol. IUPAC: 2-amino-4-(5-ethylthiophen-2-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile.
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