2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | D360-0730 |
| Compound Name: | 2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C23 H14 N2 O3 S |
| Smiles: | C(C(C1=Cc2ccccc2OC1=O)=O)Sc1c(C#N)ccc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6153 |
| logD: | 4.6153 |
| logSw: | -4.8282 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.667 |
| InChI Key: | PSHLFTMJJZRDTR-UHFFFAOYSA-N |