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Home > Pyridines > 119426-82-3
119426-82-3 | 4(1H)-Quinazolinone, 2,3-dihydro-3-(3-pyridinyl)-2-thioxo-
CAS No: 119426-82-3 Catalog No: AG000IQQ MDL No:MFCD00113288
Product Description
Catalog Number:
AG000IQQ
Chemical Name:
4(1H)-Quinazolinone, 2,3-dihydro-3-(3-pyridinyl)-2-thioxo-
CAS Number:
119426-82-3
Molecular Formula:
C13H9N3OS
Molecular Weight:
255.2951
MDL Number:
MFCD00113288
IUPAC Name:
3-pyridin-3-yl-2-sulfanylidene-1H-quinazolin-4-one
InChI:
InChI=1S/C13H9N3OS/c17-12-10-5-1-2-6-11(10)15-13(18)16(12)9-4-3-7-14-8-9/h1-8H,(H,15,18)
InChI Key:
RVKDBLWQYGIZDA-UHFFFAOYSA-N
SMILES:
S=c1[nH]c2ccccc2c(=O)n1c1cccnc1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.047g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.295g/mol
Monoisotopic Mass:
255.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Neuroprotective efficacy of quinazoline type phosphodiesterase 7 inhibitors in cellular cultures and experimental stroke model. | European journal of medicinal chemistry 20120101 |
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