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SBI-810 Hydrochloride

CAT: 1568-C18525-5mgSize: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C18525-5mgSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2772746-58-2
Storage Conditions
3 years-20°C powder 2 years-80°C in solvent

Chemical Information

SBI-810 (hydrochloride)
CAS Number2772746-58-2
PubChem CID155510650
IUPAC Name2-[[4-[4-(2-methoxyphenyl)piperidin-1-yl]-2-(1-methylcyclopropyl)quinazolin-6-yl]-methylamino]ethanol;hydrochloride
Molecular FormulaC27H35ClN4O2
Molecular Weight483.0
Topological Polar Surface Area61.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity636
SMILES
CC1(CC1)C2=NC3=C(C=C(C=C3)N(C)CCO)C(=N2)N4CCC(CC4)C5=CC=CC=C5OC.Cl
InChI
InChI=1S/C27H34N4O2.ClH/c1-27(12-13-27)26-28-23-9-8-20(30(2)16-17-32)18-22(23)25(29-26)31-14-10-19(11-15-31)21-6-4-5-7-24(21)33-3;/h4-9,18-19,32H,10-17H2,1-3H3;1H
InChIKey
SZPSBVPAWFJWAL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of SBI-810 (hydrochloride)
CAS: 2772746-58-2
CID: 155510650
Formula: C27H35ClN4O2
MW: 483.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight483.0
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass482.2448541
Monoisotopic Mass482.2448541
Topological Polar Surface Area61.7 Ų
Heavy Atom Count34
Formal Charge0
Complexity636
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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