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100061-75-4 | Thiourea, N-(8-hydroxy-2-methyl-4-oxo-3(4H)-quinazolinyl)-N'-methyl-
CAS No: 100061-75-4 Catalog No: AG0000TG MDL No:
Product Description
Catalog Number:
AG0000TG
Chemical Name:
Thiourea, N-(8-hydroxy-2-methyl-4-oxo-3(4H)-quinazolinyl)-N'-methyl-
CAS Number:
100061-75-4
Molecular Formula:
C11H12N4O2S
Molecular Weight:
264.3036
IUPAC Name:
1-(8-hydroxy-2-methyl-4-oxoquinazolin-3-yl)-3-methylthiourea
InChI:
InChI=1S/C11H12N4O2S/c1-6-13-9-7(4-3-5-8(9)16)10(17)15(6)14-11(18)12-2/h3-5,16H,1-2H3,(H2,12,14,18)
InChI Key:
XQZOCFTXBMLWPV-UHFFFAOYSA-N
SMILES:
Cc1nc2c(O)cccc2c(=O)n1NC(=S)NC
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.068g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
264.303g/mol
Monoisotopic Mass:
264.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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