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74165-76-7 | 9,10-Anthracenedione,1-amino-2-methyl-4-(2-naphthalenylamino)-
CAS No: 74165-76-7 Catalog No: AG005DVH MDL No:
Product Description
Catalog Number:
AG005DVH
Chemical Name:
9,10-Anthracenedione,1-amino-2-methyl-4-(2-naphthalenylamino)-
CAS Number:
74165-76-7
Molecular Formula:
C25H18N2O2
Molecular Weight:
378.4226
IUPAC Name:
1-amino-2-methyl-4-(naphthalen-2-ylamino)anthracene-9,10-dione
InChI:
InChI=1S/C25H18N2O2/c1-14-12-20(27-17-11-10-15-6-2-3-7-16(15)13-17)21-22(23(14)26)25(29)19-9-5-4-8-18(19)24(21)28/h2-13,27H,26H2,1H3
InChI Key:
MQOOOENBRZLPMO-UHFFFAOYSA-N
SMILES:
Cc1cc(Nc2ccc3c(c2)cccc3)c2c(c1N)C(=O)c1c(C2=O)cccc1
Properties
Complexity:
649
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.137g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
378.431g/mol
Monoisotopic Mass:
378.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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