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100223-28-7 | Pyridazine, 3-chloro-6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-
CAS No: 100223-28-7 Catalog No: AG00019Z MDL No:
Product Description
Catalog Number:
AG00019Z
Chemical Name:
Pyridazine, 3-chloro-6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-
CAS Number:
100223-28-7
Molecular Formula:
C16H19ClN4
Molecular Weight:
302.8019
IUPAC Name:
3-chloro-6-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazine
InChI:
InChI=1S/C16H19ClN4/c1-12-4-3-5-14(13(12)2)20-8-10-21(11-9-20)16-7-6-15(17)18-19-16/h3-7H,8-11H2,1-2H3
InChI Key:
SNRDLOORPUDKEI-UHFFFAOYSA-N
SMILES:
Clc1ccc(nn1)N1CCN(CC1)c1cccc(c1C)C
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.13g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.806g/mol
Monoisotopic Mass:
302.13g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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