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1632286-05-5

1632286-05-5 | Acetamide, N-(3-chloro-4-fluorophenyl)-N-(7-fluoro-6-nitro-4-quinazolinyl)-

CAS No: 1632286-05-5 Catalog No: AG001TWZ MDL No:

Product Description

Catalog Number:
AG001TWZ
Chemical Name:
Acetamide, N-(3-chloro-4-fluorophenyl)-N-(7-fluoro-6-nitro-4-quinazolinyl)-
CAS Number:
1632286-05-5
Molecular Formula:
C16H9ClF2N4O3
Molecular Weight:
378.7175
IUPAC Name:
N-(3-chloro-4-fluorophenyl)-N-(7-fluoro-6-nitroquinazolin-4-yl)acetamide
InChI:
InChI=1S/C16H9ClF2N4O3/c1-8(24)22(9-2-3-12(18)11(17)4-9)16-10-5-15(23(25)26)13(19)6-14(10)20-7-21-16/h2-7H,1H3
InChI Key:
PRHSJEPACCEZEF-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1Cl)N(c1ncnc2c1cc([N+](=O)[O-])c(c2)F)C(=O)C

Properties

Complexity:
552  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.033g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.72g/mol
Monoisotopic Mass:
378.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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