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Telomerase-IN-2

CAT: 0607-BA4534-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA4534-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1610878-54-0
Form
A solid
Molecular Formula
C34H39N3O9
Molecular Weight
633.69
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Telomerase-IN-2
CAS Number1610878-54-0
PubChem CID76285870
IUPAC Name5,7-dimethoxy-3-[4-[4-(pyridine-4-carbonyl)piperazin-1-yl]butoxy]-2-(3,4,5-trimethoxyphenyl)chromen-4-one
Molecular FormulaC34H39N3O9
Molecular Weight633.7
XLogP3.8
Topological Polar Surface Area118
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count13
Heavy Atom Count46
Formal Charge0
Complexity1020
SMILES
COC1=CC2=C(C(=C1)OC)C(=O)C(=C(O2)C3=CC(=C(C(=C3)OC)OC)OC)OCCCCN4CCN(CC4)C(=O)C5=CC=NC=C5
InChI
InChI=1S/C34H39N3O9/c1-40-24-20-25(41-2)29-26(21-24)46-31(23-18-27(42-3)32(44-5)28(19-23)43-4)33(30(29)38)45-17-7-6-12-36-13-15-37(16-14-36)34(39)22-8-10-35-11-9-22/h8-11,18-21H,6-7,12-17H2,1-5H3
InChIKey
HDOUAPSDPPFIGT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Telomerase-IN-2
CAS: 1610878-54-0
CID: 76285870
Formula: C34H39N3O9
MW: 633.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight633.7
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count13
Exact Mass633.26862983
Monoisotopic Mass633.26862983
Topological Polar Surface Area118 Ų
Heavy Atom Count46
Formal Charge0
Complexity1020
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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