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885277-89-4 | 2-(4-Bromophenyl)-4-chloro-5-methylquinazoline
CAS No: 885277-89-4 Catalog No: AG0045VG MDL No:MFCD04115265
Product Description
Catalog Number:
AG0045VG
Chemical Name:
2-(4-Bromophenyl)-4-chloro-5-methylquinazoline
CAS Number:
885277-89-4
Molecular Formula:
C15H10BrClN2
Molecular Weight:
333.6103
MDL Number:
MFCD04115265
IUPAC Name:
2-(4-bromophenyl)-4-chloro-5-methylquinazoline
InChI:
InChI=1S/C15H10BrClN2/c1-9-3-2-4-12-13(9)14(17)19-15(18-12)10-5-7-11(16)8-6-10/h2-8H,1H3
InChI Key:
CWIAZOVNENXTCE-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1nc(Cl)c2c(n1)cccc2C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.972g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.613g/mol
Monoisotopic Mass:
331.972g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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