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Home > Pyridines > 478065-69-9
478065-69-9 | 7,9-dimethyl-2-[(4-methylbenzyl)sulfanyl]-4-phenoxypyrido[3',2':4,5]thieno[3,2-d]pyrimidine
CAS No: 478065-69-9 Catalog No: AG01FOMS MDL No:
Product Description
Catalog Number:
AG01FOMS
Chemical Name:
7,9-dimethyl-2-[(4-methylbenzyl)sulfanyl]-4-phenoxypyrido[3',2':4,5]thieno[3,2-d]pyrimidine
CAS Number:
478065-69-9
IUPAC Name:
11,13-dimethyl-4-[(4-methylphenyl)methylsulfanyl]-6-phenoxy-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
InChI:
InChI=1S/C25H21N3OS2/c1-15-9-11-18(12-10-15)14-30-25-27-21-20-16(2)13-17(3)26-24(20)31-22(21)23(28-25)29-19-7-5-4-6-8-19/h4-13H,14H2,1-3H3
InChI Key:
JUTUUHXPLXFSFQ-UHFFFAOYSA-N
Properties
Complexity:
581
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
443.113g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
443.583g/mol
Monoisotopic Mass:
443.113g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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