Name: Name:4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yl acetate
Brand: Angene
SKU: AG005DFU
Rating: 90 (10 reviews)

4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yl acetate

CAS No.:

788136-89-0

Catalog Number:

AG005DFU

Molecular Formula:

C17H13ClFN3O3

Molecular Weight:

361.7548

Catalog Number:

AG005DFU

Chemical Name:

4-(3-Chloro-4-fluorophenylamino)-7-methoxyquinazolin-6-yl acetate

CAS Number:

788136-89-0

Molecular Formula:

C17H13ClFN3O3

Molecular Weight:

361.7548

MDL Number:

MFCD11618121

IUPAC Name:

[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl] acetate

InChI:

InChI=1S/C17H13ClFN3O3/c1-9(23)25-16-6-11-14(7-15(16)24-2)20-8-21-17(11)22-10-3-4-13(19)12(18)5-10/h3-8H,1-2H3,(H,20,21,22)

InChI Key:

ANGPUOTYQQFHKN-UHFFFAOYSA-N

SMILES:

COc1cc2ncnc(c2cc1OC(=O)C)Nc1ccc(c(c1)Cl)F

Complexity:

472

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

361.063g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

361.757g/mol

Monoisotopic Mass:

361.063g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9