Name: Name:(S)-N4-(3-Chloro-4-fluorophenyl)-7-(tetrahydrofuran-3-yloxy)quinazoline-4,6-diamine
Brand: Angene
SKU: AG00391I
Rating: 90 (10 reviews)

(S)-N4-(3-Chloro-4-fluorophenyl)-7-(tetrahydrofuran-3-yloxy)quinazoline-4,6-diamine

CAS No.:

314771-76-1

Catalog Number:

AG00391I

Molecular Formula:

C18H16ClFN4O2

Molecular Weight:

374.7966

Catalog Number:

AG00391I

Chemical Name:

(S)-N4-(3-Chloro-4-fluorophenyl)-7-(tetrahydrofuran-3-yloxy)quinazoline-4,6-diamine

CAS Number:

314771-76-1

Molecular Formula:

C18H16ClFN4O2

Molecular Weight:

374.7966

MDL Number:

MFCD18642925

IUPAC Name:

4-N-(3-chloro-4-fluorophenyl)-7-[(3S)-oxolan-3-yl]oxyquinazoline-4,6-diamine

InChI:

InChI=1S/C18H16ClFN4O2/c19-13-5-10(1-2-14(13)20)24-18-12-6-15(21)17(7-16(12)22-9-23-18)26-11-3-4-25-8-11/h1-2,5-7,9,11H,3-4,8,21H2,(H,22,23,24)/t11-/m0/s1

InChI Key:

BIQABKFYKJRXII-NSHDSACASA-N

SMILES:

Nc1cc2c(ncnc2cc1O[C@@H]1COCC1)Nc1ccc(c(c1)Cl)F

UNII:

Q58L53U44Y

Complexity:

477

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

374.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

374.8g/mol

Monoisotopic Mass:

374.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5