2-amino-5-oxo-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-oxo-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-5-oxo-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-1526 |
| Compound Name: | 2-amino-5-oxo-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 272.32 |
| Molecular Formula: | C14 H12 N2 O2 S |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)O2)c2cccs2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4668 |
| logD: | 1.4668 |
| logSw: | -2.067 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.621 |
| InChI Key: | QNKLFXOIWHDUEL-LBPRGKRZSA-N |