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YM-201636

CAT: 0498-bs-6709C-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0498-bs-6709C-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
371942-69-7
Conjugation
Unconjugated
Purity
98
Buffer
Powder
Solubility
Soluble in DMSO, not in water
Smiles
NC1C=CC(=CN=1)C(=O)NC1C=C(C=CC=1)C1=NC2=C(OC3N=CC=CC=32)C(=N1)N1CCOCC1
Molecular Formula
C25 H21 N7 O3
Molecular Weight
467.48
InChI
InChI=1S/C25H21N7O3/c26-19-7-6-16 (14-28-19) 24 (33) 29-17-4-1-3-15 (13-17) 22-30-20-18-5-2-8-27-25 (18) 35-21 (20) 23 (31-22) 32-9-11-34-12-10-32/h1-8,13-14H,9-12H2, (H2,26,28) (H,29,33)
Storage Conditions
Store in dry, dark place at -20C for 1 year.
Shelf Life
1 year
Appearance
Solid Power.

Chemical Information

YM-201636

6-amino-N-[3-[4-(4-morpholinyl)-2-pyrido[2,3]furo[2,4-b]pyrimidinyl]phenyl]-3-pyridinecarboxamide is an aromatic amide.

CAS Number371942-69-7
PubChem CID9956222
IUPAC Name6-amino-N-[3-(6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)phenyl]pyridine-3-carboxamide
Molecular FormulaC25H21N7O3
Molecular Weight467.5
XLogP2.5
Topological Polar Surface Area132
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count35
Formal Charge0
Complexity738
SMILES
C1COCCN1C2=NC(=NC3=C2OC4=C3C=CC=N4)C5=CC(=CC=C5)NC(=O)C6=CN=C(C=C6)N
InChI
InChI=1S/C25H21N7O3/c26-19-7-6-16(14-28-19)24(33)29-17-4-1-3-15(13-17)22-30-20-18-5-2-8-27-25(18)35-21(20)23(31-22)32-9-11-34-12-10-32/h1-8,13-14H,9-12H2,(H2,26,28)(H,29,33)
InChIKey
YBPIBGNBHHGLEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of YM-201636
CAS: 371942-69-7
CID: 9956222
Formula: C25H21N7O3
MW: 467.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.5
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass467.17058756
Monoisotopic Mass467.17058756
Topological Polar Surface Area132 Ų
Heavy Atom Count35
Formal Charge0
Complexity738
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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