3-{1-[(3-{5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl}phenyl)methyl]-6-oxo-1,6-dihydropyridazin-3-yl}benzonitrile



Compound number:
MolPort-027-720-956
CAS number: 1100598-32-0
IUPAC:
3-{1-[(3-{5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl}phenyl)methyl]-6-oxo-1,6-dihydropyridazin-3-yl}benzonitrile
IUPAC traditional:
3-{1-[(3-{5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl}phenyl)methyl]-6-oxopyridazin-3-yl}benzonitrile
SMILES:
CN1CCC(COc2cnc(nc2)-c2cccc(Cn3nc(ccc3=O)-c3cccc(c3)C#N)c2)CC1
InChI key:
AHYMHWXQRWRBKT-UHFFFAOYSA-N
Molecular formula:
C29H28N6O2
Molecular weight: 492.583
Solubility: not available

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Catalog: Screening compound Ships out: 3 business days Purity: 98.37%
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Catalog: Screening compound Ships out: 6 business days Purity: n/a
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25 mg February 1, 2021 744.33 USD
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Catalog: Building blocks Ships out: 3 business days Purity: >95%
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100 mg January 27, 2021 1296.00 USD
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Catalog: Building blocks Ships out: 6 business days Purity: 95%
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10 mg February 1, 2021 376.00 USD
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Catalog: Building blocks Ships out: 8 business days Purity: ≥98%
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Catalog: Building blocks Ships out: 5 business days Purity: 98+%
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5 mg January 29, 2021 152.00 USD
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100 mg January 29, 2021 393.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-027-720-956
CAS number: 1100598-32-0

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000043202335
MFCD18452823
3-[1,6-dihydro-1-[[3-[5-[(1-methyl-4-piperidinyl)methoxy]-2-pyrimidinyl]phenyl]methyl]-6-oxo-3-pyridazinyl]-benzonitrile
Benzonitrile, 3-[1,6-Dihydro-1-[[3-[5-[(1-Methyl-4-Piperidinyl)Methoxy]-2-PyriMidinyl]Phenyl]Methyl]-6-Oxo-3-Pyridazinyl]
EMD 1214063
Emd-1214063
Tepotinib (EMD 1214063)

InChI
InChI: 1S/C29H28N6O2/c1-34-12-10-21(11-13-34)20-37-26-17-31-29(32-18-26)25-7-3-5-23(15-25)19-35-28(36)9-8-27(33-35)24-6-2-4-22(14-24)16-30/h2-9,14-15,17-18,21H,10-13,19-20H2,1H3
InChI key: AHYMHWXQRWRBKT-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C29H28N6O2
Molecular weight: 492.583

Other

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