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(-) -Vorozole

CAT: 0931-T26322L-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T26322L-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
132042-69-4
Target
Cytochromes P450, Aromatase
Related Pathways
Metabolism, Endocrinology/Hormones
Purity
>99.99%
Bioactivity
(-) -Vorozole is an orally active non-steroidal aromatase inhibitor with potency and selectivity. (-) -Vorozole has demonstrated antitumor activity in in vivo experiments. (-) -Vorozole is used in the study of breast cancer.
Smiles
[C@H](C=1C=C2C(=CC1)N=NN2C)(C3=CC=C(Cl)C=C3)N4C=NC=N4
Molecular Formula
C16H13ClN6
Molecular Weight
324.77
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Vorozole, (-)-
CAS Number132042-69-4
PubChem CID9818699
IUPAC Name6-[(R)-(4-chlorophenyl)-(1,2,4-triazol-1-yl)methyl]-1-methylbenzotriazole
Molecular FormulaC16H13ClN6
Molecular Weight324.77
XLogP3.1
Topological Polar Surface Area61.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity402
SMILES
CN1C2=C(C=CC(=C2)[C@@H](C3=CC=C(C=C3)Cl)N4C=NC=N4)N=N1
InChI
InChI=1S/C16H13ClN6/c1-22-15-8-12(4-7-14(15)20-21-22)16(23-10-18-9-19-23)11-2-5-13(17)6-3-11/h2-10,16H,1H3/t16-/m1/s1
InChIKey
XLMPPFTZALNBFS-MRXNPFEDSA-N
Chemical Structure
2D Structure
2D structure of Vorozole, (-)-
CAS: 132042-69-4
CID: 9818699
Formula: C16H13ClN6
MW: 324.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.77
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass324.0890221
Monoisotopic Mass324.0890221
Topological Polar Surface Area61.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity402
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

Alternative Products

CatalogName
GTR19213513-01(-) -Vorozole
GTR19198531-01Vorozole
MBS5802376(-)-Vorozole
HY-19599A(Rac) -Vorozole

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