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1427460-33-0 | Methyl 2-chloro-6-(homopiperazin-1-yl)isonicotinate
CAS No: 1427460-33-0 Catalog No: AG01FGJT MDL No:
Product Description
Catalog Number:
AG01FGJT
Chemical Name:
Methyl 2-chloro-6-(homopiperazin-1-yl)isonicotinate
CAS Number:
1427460-33-0
IUPAC Name:
methyl 2-chloro-6-(1,4-diazepan-1-yl)pyridine-4-carboxylate
InChI:
InChI=1S/C12H16ClN3O2/c1-18-12(17)9-7-10(13)15-11(8-9)16-5-2-3-14-4-6-16/h7-8,14H,2-6H2,1H3
InChI Key:
PNBUKXIDAMKBCZ-UHFFFAOYSA-N
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.729g/mol
Monoisotopic Mass:
269.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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