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923791-24-6 | 2-(3,6-dioxo-1,2,3,6-tetrahydropyridazin-1-yl)-N-{1'-methyl-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-4-yl}acetamide
CAS No: 923791-24-6 Catalog No: AG01BGVQ MDL No:MFCD08264113
Product Description
Catalog Number:
AG01BGVQ
Chemical Name:
2-(3,6-dioxo-1,2,3,6-tetrahydropyridazin-1-yl)-N-{1'-methyl-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-4-yl}acetamide
CAS Number:
923791-24-6
Molecular Formula:
C20H24N4O4
Molecular Weight:
384.4290
MDL Number:
MFCD08264113
IUPAC Name:
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-(1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl)acetamide
InChI:
InChI=1S/C20H24N4O4/c1-23-10-8-20(9-11-23)12-15(14-4-2-3-5-16(14)28-20)21-18(26)13-24-19(27)7-6-17(25)22-24/h2-7,15H,8-13H2,1H3,(H,21,26)(H,22,25)
InChI Key:
BPUQEYIBZOZMGQ-UHFFFAOYSA-N
SMILES:
CN1CCC2(CC1)CC(NC(=O)Cn1[nH]c(=O)ccc1=O)c1c(O2)cccc1
Properties
Complexity:
671
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.18g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
384.436g/mol
Monoisotopic Mass:
384.18g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
91A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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