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1018-90-2 | 5H-Thiazolo[3,2-a]quinazolin-5-one, 2-(bromomethyl)-1,2-dihydro-
CAS No: 1018-90-2 Catalog No: AG0005LJ MDL No:
Product Description
Catalog Number:
AG0005LJ
Chemical Name:
5H-Thiazolo[3,2-a]quinazolin-5-one, 2-(bromomethyl)-1,2-dihydro-
CAS Number:
1018-90-2
Molecular Formula:
C11H9BrN2OS
Molecular Weight:
297.1710
IUPAC Name:
2-(bromomethyl)-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one
InChI:
InChI=1S/C11H9BrN2OS/c12-5-7-6-14-9-4-2-1-3-8(9)10(15)13-11(14)16-7/h1-4,7H,5-6H2
InChI Key:
IOLKMXUAMNVGKH-UHFFFAOYSA-N
SMILES:
BrCC1Cn2c(S1)nc(=O)c1c2cccc1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.962g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.17g/mol
Monoisotopic Mass:
295.962g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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