2-amino-6-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-6-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile
2-amino-6-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile
Compound characteristics
| Compound ID: | Y500-0300 |
| Compound Name: | 2-amino-6-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile |
| Molecular Weight: | 312.35 |
| Molecular Formula: | C14 H12 N6 O S |
| Smiles: | Cc1cc(C)n(C(CSc2c(C#N)cc(C#N)c(N)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.5657 |
| logD: | 0.5657 |
| logSw: | -1.8029 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.335 |
| InChI Key: | FHDQMKKXHZPVLV-UHFFFAOYSA-N |