Name: Name:N-(3-Chloro-4-fluorophenyl)-N-(7-methoxy-6-nitroquinazolin-4-yl)acetamide
Brand: Angene
SKU: AG01EN0K
Rating: 90 (10 reviews)

N-(3-Chloro-4-fluorophenyl)-N-(7-methoxy-6-nitroquinazolin-4-yl)acetamide

CAS No.:

869199-61-1

Catalog Number:

AG01EN0K

Molecular Formula:

C17H12ClFN4O4

Molecular Weight:

390.7530

Catalog Number:

AG01EN0K

Chemical Name:

N-(3-Chloro-4-fluorophenyl)-N-(7-methoxy-6-nitroquinazolin-4-yl)acetamide

CAS Number:

869199-61-1

Molecular Formula:

C17H12ClFN4O4

Molecular Weight:

390.7530

MDL Number:

MFCD30536257

IUPAC Name:

N-(3-chloro-4-fluorophenyl)-N-(7-methoxy-6-nitroquinazolin-4-yl)acetamide

InChI:

InChI=1S/C17H12ClFN4O4/c1-9(24)22(10-3-4-13(19)12(18)5-10)17-11-6-15(23(25)26)16(27-2)7-14(11)20-8-21-17/h3-8H,1-2H3

InChI Key:

LTZBDIKMPORGBC-UHFFFAOYSA-N

SMILES:

COc1cc2ncnc(c2cc1[N+](=O)[O-])N(c1ccc(c(c1)Cl)F)C(=O)C

Complexity:

566

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

390.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

390.755g/mol

Monoisotopic Mass:

390.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3