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Home > Pyridines > 223797-09-9
223797-09-9 | 1-(6-phenylpyridazin-3-yl)-1,4-diazepane
CAS No: 223797-09-9 Catalog No: AG01AB9L MDL No:MFCD07386172
Product Description
Catalog Number:
AG01AB9L
Chemical Name:
1-(6-phenylpyridazin-3-yl)-1,4-diazepane
CAS Number:
223797-09-9
Molecular Formula:
C15H18N4
Molecular Weight:
254.3302
MDL Number:
MFCD07386172
IUPAC Name:
1-(6-phenylpyridazin-3-yl)-1,4-diazepane
InChI:
InChI=1S/C15H18N4/c1-2-5-13(6-3-1)14-7-8-15(18-17-14)19-11-4-9-16-10-12-19/h1-3,5-8,16H,4,9-12H2
InChI Key:
BZHONZCRWRTGTE-UHFFFAOYSA-N
SMILES:
N1CCCN(CC1)c1ccc(nn1)c1ccccc1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.153g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.337g/mol
Monoisotopic Mass:
254.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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