2-amino-4-(5-methylfuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzothiopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-methylfuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzothiopyran-3-carbonitrile
2-amino-4-(5-methylfuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzothiopyran-3-carbonitrile
Compound characteristics
| Compound ID: | Y501-6964 |
| Compound Name: | 2-amino-4-(5-methylfuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzothiopyran-3-carbonitrile |
| Molecular Weight: | 286.35 |
| Molecular Formula: | C15 H14 N2 O2 S |
| Smiles: | Cc1ccc(C2C(C#N)=C(N)SC3CCCC(C2=3)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4355 |
| logD: | 2.4355 |
| logSw: | -2.5875 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.551 |
| InChI Key: | ZOLJSKITHSLMLR-CYBMUJFWSA-N |