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MK-8153

CAT: 0013-GTR19186056-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19186056-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
MK-8153
CAS Number
1548286-45-8
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C1C2 (CCN1C3=C (C) C (=O) OC3) CCN (C[C@H] (O) C=4C (C) =C5C (=CC4) C (=O) OC5) CC2
Molecular Formula
C24H28N2O6
Molecular Weight
440.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-1,3-dihydro-2-benzofuran-5-yl)ethyl]-2-(4-methyl-5-oxo-2,5-dihydrofuran-3-yl)-2,8-diazaspiro[4.5]decan-1-one
CAS Number1548286-45-8
PubChem CID72950074
IUPAC Name8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-2-(4-methyl-5-oxo-2H-furan-3-yl)-2,8-diazaspiro[4.5]decan-1-one
Molecular FormulaC24H28N2O6
Molecular Weight440.5
XLogP0.8
Topological Polar Surface Area96.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity845
SMILES
CC1=C(C=CC2=C1COC2=O)[C@H](CN3CCC4(CC3)CCN(C4=O)C5=C(C(=O)OC5)C)O
InChI
InChI=1S/C24H28N2O6/c1-14-16(3-4-17-18(14)12-31-22(17)29)20(27)11-25-8-5-24(6-9-25)7-10-26(23(24)30)19-13-32-21(28)15(19)2/h3-4,20,27H,5-13H2,1-2H3/t20-/m0/s1
InChIKey
KDAIMYGCILCZSH-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-1,3-dihydro-2-benzofuran-5-yl)ethyl]-2-(4-methyl-5-oxo-2,5-dihydrofuran-3-yl)-2,8-diazaspiro[4.5]decan-1-one
CAS: 1548286-45-8
CID: 72950074
Formula: C24H28N2O6
MW: 440.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight440.5
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass440.19473662
Monoisotopic Mass440.19473662
Topological Polar Surface Area96.4 Ų
Heavy Atom Count32
Formal Charge0
Complexity845
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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