2-[4-(4-methyl-1H-imidazol-5-yl)piperidin-1-yl]-1,3-diazatricyclo[6.3.1.0⁴,¹²]dodeca-2,4,6,8(12)-tetraen-9-one

Compound number:
MolPort-023-276-917
CAS number: 163120-31-8
IUPAC:
2-[4-(4-methyl-1H-imidazol-5-yl)piperidin-1-yl]-1,3-diazatricyclo[6.3.1.0⁴,¹²]dodeca-2,4,6,8(12)-tetraen-9-one
IUPAC traditional:
2-[4-(5-methyl-3H-imidazol-4-yl)piperidin-1-yl]-1,3-diazatricyclo[6.3.1.0⁴,¹²]dodeca-2,4,6,8(12)-tetraen-9-one
SMILES:
Cc1nc[nH]c1C1CCN(CC1)c1nc2cccc3C(=O)CCn1c23
InChI key:
YKJJROIKVYSPDH-UHFFFAOYSA-N
Molecular formula:
C19H21N5O
Molecular weight: 335.411
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 5 business days Purity: >98%
Last updated: this month In warehouse: Unverified
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1 mg October 25, 2019 110.92 USD
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More Information

Compound Identifiers
Compound number: MolPort-023-276-917
CAS number: 163120-31-8

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000059103853
BYK 49187

InChI
InChI: 1S/C19H21N5O/c1-12-17(21-11-20-12)13-5-8-23(9-6-13)19-22-15-4-2-3-14-16(25)7-10-24(19)18(14)15/h2-4,11,13H,5-10H2,1H3,(H,20,21)
InChI key: YKJJROIKVYSPDH-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C19H21N5O
Molecular weight: 335.411

Other

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2019 MolPort, v3.22, release date 14-10-2019 15:00 (+0200). All rights reserved.
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