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6962-00-1 | Thiazolo[5,4-d]thiazole,2,5-bis(2,4-dimethoxyphenyl)-
CAS No: 6962-00-1 Catalog No: AG005JYP MDL No:
Product Description
Catalog Number:
AG005JYP
Chemical Name:
Thiazolo[5,4-d]thiazole,2,5-bis(2,4-dimethoxyphenyl)-
CAS Number:
6962-00-1
Molecular Formula:
C20H18N2O4S2
Molecular Weight:
414.4979
IUPAC Name:
2,5-bis(2,4-dimethoxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazole
InChI:
InChI=1S/C20H18N2O4S2/c1-23-11-5-7-13(15(9-11)25-3)17-21-19-20(27-17)22-18(28-19)14-8-6-12(24-2)10-16(14)26-4/h5-10H,1-4H3
InChI Key:
GUFPLICAYOTWJV-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1c1nc2c(s1)nc(s2)c1ccc(cc1OC)OC
NSC Number:
33625
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.071g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
414.494g/mol
Monoisotopic Mass:
414.071g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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