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148902-86-7 | 9(10H)-Acridinone, 4-[(2-aminoethyl)amino]-10-methyl-1-nitro-
CAS No: 148902-86-7 Catalog No: AG001L9S MDL No:
Product Description
Catalog Number:
AG001L9S
Chemical Name:
9(10H)-Acridinone, 4-[(2-aminoethyl)amino]-10-methyl-1-nitro-
CAS Number:
148902-86-7
Molecular Formula:
C16H16N4O3
Molecular Weight:
312.3232
IUPAC Name:
4-(2-aminoethylamino)-10-methyl-1-nitroacridin-9-one
InChI:
InChI=1S/C16H16N4O3/c1-19-12-5-3-2-4-10(12)16(21)14-13(20(22)23)7-6-11(15(14)19)18-9-8-17/h2-7,18H,8-9,17H2,1H3
InChI Key:
IDBWSKFVWNOHNE-UHFFFAOYSA-N
SMILES:
NCCNc1ccc(c2c1n(C)c1ccccc1c2=O)[N+](=O)[O-]
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.122g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
312.329g/mol
Monoisotopic Mass:
312.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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