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149902-44-3 | 1H,5H,11H-[1]Benzopyrano[6,7,8-ij]quinolizine-9-pentanoic acid, 2,3,6,7-tetrahydro-, hydrazide
CAS No: 149902-44-3 Catalog No: AG001M3P MDL No:
Product Description
Catalog Number:
AG001M3P
Chemical Name:
1H,5H,11H-[1]Benzopyrano[6,7,8-ij]quinolizine-9-pentanoic acid, 2,3,6,7-tetrahydro-, hydrazide
CAS Number:
149902-44-3
Molecular Formula:
C20H27N3O2
Molecular Weight:
341.4473
IUPAC Name:
5-(3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),5,8-tetraen-6-yl)pentanehydrazide
InChI:
InChI=1S/C20H27N3O2/c21-22-18(24)8-2-1-5-14-9-12-25-20-16-7-4-11-23-10-3-6-15(19(16)23)13-17(14)20/h9,13H,1-8,10-12,21H2,(H,22,24)
InChI Key:
XNHDECCSCKLOQI-UHFFFAOYSA-N
SMILES:
NNC(=O)CCCCC1=CCOc2c1cc1CCCN3c1c2CCC3
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.21g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.455g/mol
Monoisotopic Mass:
341.21g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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