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Telomerase-IN-3

CAT: 0607-BA4533-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA4533-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
150096-77-8
Form
A solid
Molecular Formula
C19H16ClN5O3
Molecular Weight
397.82
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Telomerase-IN-3
CAS Number150096-77-8
PubChem CID24834263
IUPAC Name2-amino-N-[[4-(5-chloropyrimidin-2-yl)oxy-3-methylphenyl]carbamoyl]benzamide
Molecular FormulaC19H16ClN5O3
Molecular Weight397.8
XLogP3.9
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity544
SMILES
CC1=C(C=CC(=C1)NC(=O)NC(=O)C2=CC=CC=C2N)OC3=NC=C(C=N3)Cl
InChI
InChI=1S/C19H16ClN5O3/c1-11-8-13(6-7-16(11)28-19-22-9-12(20)10-23-19)24-18(27)25-17(26)14-4-2-3-5-15(14)21/h2-10H,21H2,1H3,(H2,24,25,26,27)
InChIKey
NLVSCQFSPVSAOF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Telomerase-IN-3
CAS: 150096-77-8
CID: 24834263
Formula: C19H16ClN5O3
MW: 397.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight397.8
XLogP33.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass397.0941671
Monoisotopic Mass397.0941671
Topological Polar Surface Area119 Ų
Heavy Atom Count28
Formal Charge0
Complexity544
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