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MIR96-IN-1 5mg

CAT: 0628-A20926-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A20926-5Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1311982-88-3

Chemical Information

N-(3-Azidopropyl)-4-(2,6-di-tert-butyl-4-(6-(4-methylpiperazin-1-yl)-1H-benzo[d]imidazol-2-yl)phenoxy)butanamide
CAS Number1311982-88-3
PubChem CID72699186
IUPAC NameN-(3-azidopropyl)-4-[2,6-ditert-butyl-4-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]phenoxy]butanamide
Molecular FormulaC33H48N8O2
Molecular Weight588.8
XLogP7.3
Topological Polar Surface Area87.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Heavy Atom Count43
Formal Charge0
Complexity910
SMILES
CC(C)(C)C1=CC(=CC(=C1OCCCC(=O)NCCCN=[N+]=[N-])C(C)(C)C)C2=NC3=C(N2)C=C(C=C3)N4CCN(CC4)C
InChI
InChI=1S/C33H48N8O2/c1-32(2,3)25-20-23(31-37-27-12-11-24(22-28(27)38-31)41-17-15-40(7)16-18-41)21-26(33(4,5)6)30(25)43-19-8-10-29(42)35-13-9-14-36-39-34/h11-12,20-22H,8-10,13-19H2,1-7H3,(H,35,42)(H,37,38)
InChIKey
LTPQCIXFOJELHJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3-Azidopropyl)-4-(2,6-di-tert-butyl-4-(6-(4-methylpiperazin-1-yl)-1H-benzo[d]imidazol-2-yl)phenoxy)butanamide
CAS: 1311982-88-3
CID: 72699186
Formula: C33H48N8O2
MW: 588.8
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight588.8
XLogP37.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Exact Mass588.39002280
Monoisotopic Mass588.39002280
Topological Polar Surface Area87.9 Ų
Heavy Atom Count43
Formal Charge0
Complexity910
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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BA3076-5.1MIR96-IN-1
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HP300629MIR96 Human qPCR Primer Pair (MI0000098)
QH78245SHuman MIR96 qPCR Primer Pair
QM77466SMouse Mir96 qPCR Primer Pair
ORF025080MIR96 ORF Vector (Human) (pORF)
RP300420MIR96 Rat qPCR Primer Pair (MI0000881)
RK300420MIR96 Rat qPCR Template Standard (MI0000881)
MP300540Mir96 Mouse qPCR Primer Pair (MI0000583)
MK300540Mir96 Mouse qPCR Template Standard (MI0000583)

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