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1160245-26-0 | 1-[(1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)carbonyl]-N-phenylpiperidine-3-carboxamide hydrochloride
CAS No: 1160245-26-0 Catalog No: AG00JDIZ MDL No:MFCD12197649
Product Description
Catalog Number:
AG00JDIZ
Chemical Name:
1-[(1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)carbonyl]-N-phenylpiperidine-3-carboxamide hydrochloride
CAS Number:
1160245-26-0
Molecular Formula:
C20H25N5O2
Molecular Weight:
367.4448
MDL Number:
MFCD12197649
IUPAC Name:
1-(1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbonyl)-N-phenylpiperidine-3-carboxamide;hydrochloride
InChI:
InChI=1S/C20H25N5O2.ClH/c1-24-17-9-10-21-12-16(17)18(23-24)20(27)25-11-5-6-14(13-25)19(26)22-15-7-3-2-4-8-15;/h2-4,7-8,14,21H,5-6,9-13H2,1H3,(H,22,26);1H
InChI Key:
FJDCASWWINTZRO-UHFFFAOYSA-N
SMILES:
O=C(C1CCCN(C1)C(=O)c1nn(c2c1CNCC2)C)Nc1ccccc1
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.178g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
403.911g/mol
Monoisotopic Mass:
403.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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