2,7-dimethyl-5-oxo-2,3-dihydro-5H-[1,3]oxazolo[3,2-a]pyridine-8-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
2,7-dimethyl-5-oxo-2,3-dihydro-5H-[1,3]oxazolo[3,2-a]pyridine-8-carbonitrile--hydrogen chloride (1/1)
2,7-dimethyl-5-oxo-2,3-dihydro-5H-[1,3]oxazolo[3,2-a]pyridine-8-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8017-2101 |
| Compound Name: | 2,7-dimethyl-5-oxo-2,3-dihydro-5H-[1,3]oxazolo[3,2-a]pyridine-8-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 226.66 |
| Molecular Formula: | C10 H10 N2 O2 |
| Salt: | HCl |
| Smiles: | CC1CN2C(=C(C#N)C(C)=CC2=O)O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8852 |
| logD: | 0.8852 |
| logSw: | -0.4477 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.284 |
| InChI Key: | YPHSVUNQNXOAER-ZETCQYMHSA-N |