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171915-93-8 | 2,9-Di(1,3-thiazol-2-tl)anthra2,1,9-def
CAS No: 171915-93-8 Catalog No: AG00AOWH MDL No:
Product Description
Catalog Number:
AG00AOWH
Chemical Name:
2,9-Di(1,3-thiazol-2-tl)anthra2,1,9-def
CAS Number:
171915-93-8
IUPAC Name:
7,18-bis(1,3-thiazol-2-yl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
InChI:
InChI=1S/C30H12N4O4S2/c35-25-17-5-1-13-14-2-6-19-24-20(28(38)34(27(19)37)30-32-10-12-40-30)8-4-16(22(14)24)15-3-7-18(23(17)21(13)15)26(36)33(25)29-31-9-11-39-29/h1-12H
InChI Key:
MPCJDAAOZYPRER-UHFFFAOYSA-N
Properties
Complexity:
1010
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
556.03g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
556.57g/mol
Monoisotopic Mass:
556.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
157A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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