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923274-28-6 | 4(3H)-Quinazolinone, 2-[4-(1-methylethyl)-2-thiazolyl]-
CAS No: 923274-28-6 Catalog No: AG006KI3 MDL No:
Product Description
Catalog Number:
AG006KI3
Chemical Name:
4(3H)-Quinazolinone, 2-[4-(1-methylethyl)-2-thiazolyl]-
CAS Number:
923274-28-6
Molecular Formula:
C14H13N3OS
Molecular Weight:
271.3375
IUPAC Name:
2-(4-propan-2-yl-1,3-thiazol-2-yl)-3H-quinazolin-4-one
InChI:
InChI=1S/C14H13N3OS/c1-8(2)11-7-19-14(16-11)12-15-10-6-4-3-5-9(10)13(18)17-12/h3-8H,1-2H3,(H,15,17,18)
InChI Key:
VRNQWDAFURICAH-UHFFFAOYSA-N
SMILES:
CC(c1csc(n1)c1nc2ccccc2c(=O)[nH]1)C
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.338g/mol
Monoisotopic Mass:
271.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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