AC1MVJA3
2-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)sulfanyl]acetic acid
Also Known As: Oprea1_527307|2-((5-cyano-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)thio)acetic acid|2-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)sulfanyl]acetic acid
CAS: 204775-48-4
| Molecular Formula | C17H21N3O3S2 |
|---|---|
| Molecular Weight | 379.10245 g/mol |
| LogP | 2.53448 |
| Topological Polar Surface Area | 86.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.10245 |
| Monoisotopic Mass | 379.10245 |
| Heavy Atoms | 25 |
| Complexity | 724.82874 |
Chemical Identifiers
| CAS Number | 204775-48-4 |
|---|---|
| SMILES | CC1(CC2=C(CS1)C(=NC(=C2C#N)SCC(=O)O)N3CCOCC3)C |
Product Overview
AC1MVJA3 (CAS 204775-48-4), with molecular formula C17H21N3O3S2 and molecular weight 379.10245 g/mol. IUPAC: 2-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)sulfanyl]acetic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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