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845885-87-2 | 4-HOMOPIPERAZINEFURO[3,2-C]PYRIDINE
CAS No: 845885-87-2 Catalog No: AG00G33T MDL No:MFCD06658987
Product Description
Catalog Number:
AG00G33T
Chemical Name:
4-HOMOPIPERAZINEFURO[3,2-C]PYRIDINE
CAS Number:
845885-87-2
Molecular Formula:
C12H15N3O
Molecular Weight:
217.2670
MDL Number:
MFCD06658987
IUPAC Name:
4-(1,4-diazepan-1-yl)furo[3,2-c]pyridine
InChI:
InChI=1S/C12H15N3O/c1-4-13-6-8-15(7-1)12-10-3-9-16-11(10)2-5-14-12/h2-3,5,9,13H,1,4,6-8H2
InChI Key:
JGVLLHBTSVQMHS-UHFFFAOYSA-N
SMILES:
N1CCCN(CC1)c1nccc2c1cco2
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.272g/mol
Monoisotopic Mass:
217.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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