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Home > Imidazoles > 1422135-55-4
1422135-55-4 | 1-(pyrrolidin-1-yl)-2-((6,7,8,9-tetrahydro-5H-imidazo[1,2-a][1,4]diazepin-6-yl)methoxy)ethanone
CAS No: 1422135-55-4 Catalog No: AG01DINY MDL No:
Product Description
Catalog Number:
AG01DINY
Chemical Name:
1-(pyrrolidin-1-yl)-2-((6,7,8,9-tetrahydro-5H-imidazo[1,2-a][1,4]diazepin-6-yl)methoxy)ethanone
CAS Number:
1422135-55-4
Molecular Formula:
C14H22N4O2
Molecular Weight:
278.3501
IUPAC Name:
1-pyrrolidin-1-yl-2-(6,7,8,9-tetrahydro-5H-imidazo[1,2-a][1,4]diazepin-6-ylmethoxy)ethanone
InChI:
InChI=1S/C14H22N4O2/c19-14(17-4-1-2-5-17)11-20-10-12-7-15-8-13-16-3-6-18(13)9-12/h3,6,12,15H,1-2,4-5,7-11H2
InChI Key:
HWVBFWFOAQKYGY-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1)COCC1CNCc2n(C1)ccn2
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.356g/mol
Monoisotopic Mass:
278.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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