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199852-35-2 | 5H-Thiazolo[3,2-a]pyrimidin-5-one, 7-[(3,5-dimethylphenyl)methyl]-3-ethoxy-6-ethyl-2,3-dihydro-
CAS No: 199852-35-2 Catalog No: AG002CEL MDL No:
Product Description
Catalog Number:
AG002CEL
Chemical Name:
5H-Thiazolo[3,2-a]pyrimidin-5-one, 7-[(3,5-dimethylphenyl)methyl]-3-ethoxy-6-ethyl-2,3-dihydro-
CAS Number:
199852-35-2
Molecular Formula:
C19H24N2O2S
Molecular Weight:
344.4711
IUPAC Name:
7-[(3,5-dimethylphenyl)methyl]-3-ethoxy-6-ethyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
InChI:
InChI=1S/C19H24N2O2S/c1-5-15-16(10-14-8-12(3)7-13(4)9-14)20-19-21(18(15)22)17(11-24-19)23-6-2/h7-9,17H,5-6,10-11H2,1-4H3
InChI Key:
PFHMOKLEJJDAJB-UHFFFAOYSA-N
SMILES:
CCOC1CSc2n1c(=O)c(c(n2)Cc1cc(C)cc(c1)C)CC
Properties
Complexity:
548
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.156g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.473g/mol
Monoisotopic Mass:
344.156g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-HIV-1 activity of novel 2,3-dihydro-7H-thiazolo[3,2-a]pyrimidin-7-ones. | Journal of medicinal chemistry 19980115 |
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