200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1803581-97-6
1803581-97-6 | 5-(4-methylpiperazin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one, carbonic acid
CAS No: 1803581-97-6 Catalog No: AG01B8ZY MDL No:MFCD28348192
Product Description
Catalog Number:
AG01B8ZY
Chemical Name:
5-(4-methylpiperazin-1-yl)-2-(piperidin-3-yl)-2,3-dihydropyridazin-3-one, carbonic acid
CAS Number:
1803581-97-6
Molecular Formula:
C15H25N5O4
Molecular Weight:
339.3901
MDL Number:
MFCD28348192
IUPAC Name:
carbonic acid;5-(4-methylpiperazin-1-yl)-2-piperidin-3-ylpyridazin-3-one
InChI:
InChI=1S/C14H23N5O.CH2O3/c1-17-5-7-18(8-6-17)13-9-14(20)19(16-11-13)12-3-2-4-15-10-12;2-1(3)4/h9,11-12,15H,2-8,10H2,1H3;(H2,2,3,4)
InChI Key:
MEIRQZUCJOSWRK-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1cnn(c(=O)c1)C1CCCNC1.OC(=O)O
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.191g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
339.396g/mol
Monoisotopic Mass:
339.191g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.