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VPC-14449

CAT: 0931-T24944-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T24944-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1621375-32-3
Target
Androgen Receptor
Related Pathways
Endocrinology/Hormones
Purity
0.9956
Bioactivity
VPC-14449 is a selective androgen receptor DNA-binding domain (AR-DBD) inhibitor, useful in prostate cancer research.
Smiles
BrC=1N=C(Br)N(C1)C=2N=C(SC2)N3CCOCC3
Molecular Formula
C10H10Br2N4OS
Molecular Weight
394.09
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-(4-(2,4-dibromo-1H-imidazol-1-yl)thiazol-2-yl)morpholine
CAS Number1621375-32-3
PubChem CID135150480
IUPAC Name4-[4-(2,4-dibromoimidazol-1-yl)-1,3-thiazol-2-yl]morpholine
Molecular FormulaC10H10Br2N4OS
Molecular Weight394.09
XLogP3.2
Topological Polar Surface Area71.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity295
SMILES
C1COCCN1C2=NC(=CS2)N3C=C(N=C3Br)Br
InChI
InChI=1S/C10H10Br2N4OS/c11-7-5-16(9(12)13-7)8-6-18-10(14-8)15-1-3-17-4-2-15/h5-6H,1-4H2
InChIKey
AZLNRGRZOLVWRX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(4-(2,4-dibromo-1H-imidazol-1-yl)thiazol-2-yl)morpholine
CAS: 1621375-32-3
CID: 135150480
Formula: C10H10Br2N4OS
MW: 394.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.09
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass393.89216
Monoisotopic Mass391.89421
Topological Polar Surface Area71.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity295
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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