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82491-75-6 | 3,10'-Bi-10H-phenothiazine, 10-phenyl-
CAS No: 82491-75-6 Catalog No: AG008JFW MDL No:
Product Description
Catalog Number:
AG008JFW
Chemical Name:
3,10'-Bi-10H-phenothiazine, 10-phenyl-
CAS Number:
82491-75-6
Molecular Formula:
C30H20N2S2
Molecular Weight:
472.6232
IUPAC Name:
3-phenothiazin-10-yl-10-phenylphenothiazine
InChI:
InChI=1S/C30H20N2S2/c1-2-10-21(11-3-1)31-23-12-4-9-17-29(23)34-30-20-22(18-19-26(30)31)32-24-13-5-7-15-27(24)33-28-16-8-6-14-25(28)32/h1-20H
InChI Key:
JAIRBQSVFOVSRP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N1c2ccc(cc2Sc2c1cccc2)N1c2ccccc2Sc2c1cccc2
Properties
Complexity:
673
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
472.107g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
472.624g/mol
Monoisotopic Mass:
472.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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