| CAS Number | 1094067-13-6 |
| Catalog Number | AG008TN4(AGN-PC-0OZIBG) |
| Chemical Name | 2-(Ethyl((5-((6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl)amino)isothiazol-3-yl)methyl)amino)-2-methylpropan-1-ol xhydrochloride |
| IUPAC Name | 2-[ethyl-[[5-[[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]methyl]amino]-2-methylpropan-1-ol;hydrochloride |
| InChI | InChI=1S/C20H26N8OS.ClH/c1-5-27(20(3,4)12-29)11-15-6-17(30-26-15)25-18-19-21-9-16(14-7-22-23-8-14)28(19)10-13(2)24-18;/h6-10,29H,5,11-12H2,1-4H3,(H,22,23)(H,24,25);1H |
| InChI Key | YBAZMWNWFHDNTH-UHFFFAOYSA-N |
| MDL Number | MFCD18251447 |
| Molecular Formula | C20H27ClN8OS |
| Molecular Weight | 462.9994 |
| SMILES | Cl.OCC(N(CC1=NSC(=C1)NC2=NC(=CN3C2=NC=C3C=4C=NNC4)C)CC)(C)C |
| Synonyms | SCH-1473759 (hydrochloride),
SCH-1473759 hydrochloride,
1094067-13-6,
CHEMBL1650533,
SCH1473759 (HCl salt),
AKOS030526250,
CS-3477,
HY-10483,
|
| Complexity | 569 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 462.172g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 463.001g/mol |
| Monoisotopic Mass | 462.172g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 136A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number