6-bromo-4-methoxyquinazoline

6-bromo-4-methoxyquinazoline

CAS: 915924-79-7

Formula: C9H7BrN2O

SMILES: COC1=NC=NC2=CC=C(Br)C=C12

IUPAC: 6-bromo-4-methoxyquinazoline

InChI: InChI=1S/C9H7BrN2O/c1-13-9-7-4-6(10)2-3-8(7)11-5-12-9/h2-5H,1H3

Composition: C (45.22%), H (2.95%), Br (33.42%), N (11.72%), O (6.69%)

Molar Mass: 239.072

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.974176
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	SCWYBXFJOPLSQA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.2
Topological Polar Surface Area	35.01
Polarizability	21.32
Ring Count	2
Rotatable Bond Count	1

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