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1160245-36-2 | 1-methyl-3-{[3-(pyrrolidin-1-ylcarbonyl)piperidin-1-yl]carbonyl}-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine hydrochloride
CAS No: 1160245-36-2 Catalog No: AG00JDJ9 MDL No:MFCD12197659
Product Description
Catalog Number:
AG00JDJ9
Chemical Name:
1-methyl-3-{[3-(pyrrolidin-1-ylcarbonyl)piperidin-1-yl]carbonyl}-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine hydrochloride
CAS Number:
1160245-36-2
Molecular Formula:
C18H27N5O2
Molecular Weight:
345.4393
MDL Number:
MFCD12197659
IUPAC Name:
[1-(1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone;hydrochloride
InChI:
InChI=1S/C18H27N5O2.ClH/c1-21-15-6-7-19-11-14(15)16(20-21)18(25)23-10-4-5-13(12-23)17(24)22-8-2-3-9-22;/h13,19H,2-12H2,1H3;1H
InChI Key:
KVIQCFQGMXZMFW-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1)C1CCCN(C1)C(=O)c1nn(c2c1CNCC2)C
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.193g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
381.905g/mol
Monoisotopic Mass:
381.193g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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