4,7-dichloro-2-oxo-2H-[1,3]dithiolo[4,5-c]pyridine-6-carbonitrile
Chemical Structure Depiction of
4,7-dichloro-2-oxo-2H-[1,3]dithiolo[4,5-c]pyridine-6-carbonitrile
4,7-dichloro-2-oxo-2H-[1,3]dithiolo[4,5-c]pyridine-6-carbonitrile
Compound characteristics
| Compound ID: | 8008-1004 |
| Compound Name: | 4,7-dichloro-2-oxo-2H-[1,3]dithiolo[4,5-c]pyridine-6-carbonitrile |
| Molecular Weight: | 263.12 |
| Molecular Formula: | C7 Cl2 N2 O S2 |
| Smiles: | C(c1c(c2c(c(n1)[Cl])SC(=O)S2)[Cl])#N |
| Stereo: | ACHIRAL |
| logP: | 2.7789 |
| logD: | 2.7789 |
| logSw: | -3.6032 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.099 |
| InChI Key: | DNPAIGFYNFCAPJ-UHFFFAOYSA-N |