MolPort-002-143-731
2-[(E)-[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-4,5-dimethylthiophene-3-carbonitrile
Also Known As: MolPort-002-143-731|A0906/0042547|2-({(E)-[4-(dimethylamino)-3-nitrophenyl]methylidene}amino)-4,5-dimethylthiophene-3-carbonitrile|2-({(E)-1-[4-(dimethylamino)-3-nitrophenyl]methylidene}amino)-4,5-dimethyl-3-thienyl cyanide|2-[(E)-{[4-(DIMETHYLAMINO)-3-NITROPHENYL]METHYLIDENE}AMINO]-4,5-DIMETHYLTHIOPHENE-3-CARBONITRILE
| Molecular Formula | C16H16N4O2S |
|---|---|
| Molecular Weight | 328.0994 g/mol |
| LogP | 3.96142 |
| Topological Polar Surface Area | 82.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.0994 |
| Monoisotopic Mass | 328.0994 |
| Heavy Atoms | 23 |
| Complexity | 831.3363 |
Chemical Identifiers
| CAS Number | 5309-00-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)/N=C/C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-])C |
Product Overview
MolPort-002-143-731 (CAS 5309-00-2), with molecular formula C16H16N4O2S and molecular weight 328.0994 g/mol. IUPAC: 2-[(E)-[4-(dimethylamino)-3-nitrophenyl]methylideneamino]-4,5-dimethylthiophene-3-carbonitrile.
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