7-chloro-N-(4-methoxy-2-methylphenyl)quinazolin-4-amine

7-chloro-N-(4-methoxy-2-methylphenyl)quinazolin-4-amine

CAS: 477856-42-1

Formula: C16H14ClN3O

SMILES: COC1=CC(C)=C(NC2=C3C=CC(Cl)=CC3=NC=N2)C=C1

IUPAC: 7-chloro-N-(4-methoxy-2-methylphenyl)quinazolin-4-amine

InChI: InChI=1S/C16H14ClN3O/c1-10-7-12(21-2)4-6-14(10)20-16-13-5-3-11(17)8-15(13)18-9-19-16/h3-9H,1-2H3,(H,18,19,20)

Composition: C (64.11%), H (4.71%), Cl (11.83%), N (14.02%), O (5.34%)

Molar Mass: 299.76

Atom Count: 35

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	299.0825398
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GDRNOVDFEMIOSM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.91
Topological Polar Surface Area	47.04
Polarizability	32.93
Ring Count	3
Rotatable Bond Count	3

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