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58566-08-8 | 3,4-Dihydro-8-methoxy-3'-methyl-4-[(3-methylbenzothiazol-2(3H)-ylidene)methyl]spiro[2H-1-benzopyran-2,2'(3'H)-benzothiazole]
CAS No: 58566-08-8 Catalog No: AG00EUG1 MDL No:
Product Description
Catalog Number:
AG00EUG1
Chemical Name:
3,4-Dihydro-8-methoxy-3'-methyl-4-[(3-methylbenzothiazol-2(3H)-ylidene)methyl]spiro[2H-1-benzopyran-2,2'(3'H)-benzothiazole]
CAS Number:
58566-08-8
IUPAC Name:
8'-methoxy-3-methyl-4'-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)methyl]spiro[1,3-benzothiazole-2,2'-3,4-dihydrochromene]
InChI:
InChI=1S/C26H24N2O2S2/c1-27-19-10-4-6-13-22(19)31-24(27)15-17-16-26(28(2)20-11-5-7-14-23(20)32-26)30-25-18(17)9-8-12-21(25)29-3/h4-15,17H,16H2,1-3H3/b24-15-
InChI Key:
ZBHJDMDVLDATCX-IWIPYMOSSA-N
Properties
Complexity:
735
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
460.128g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
460.61g/mol
Monoisotopic Mass:
460.128g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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