6,7-dimethoxy-N-(4-nitrophenyl)quinazolin-4-amine

6,7-dimethoxy-N-(4-nitrophenyl)quinazolin-4-amine

CAS: 765899-28-3

Formula: C16H14N4O4

SMILES: COC1=C(OC)C=C2C(NC3=CC=C(C=C3)[N+]([O-])=O)=NC=NC2=C1

IUPAC: 6,7-dimethoxy-N-(4-nitrophenyl)quinazolin-4-amine

InChI: InChI=1S/C16H14N4O4/c1-23-14-7-12-13(8-15(14)24-2)17-9-18-16(12)19-10-3-5-11(6-4-10)20(21)22/h3-9H,1-2H3,(H,17,18,19)

Composition: C (58.89%), H (4.32%), N (17.17%), O (19.61%)

Molar Mass: 326.312

Atom Count: 38

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	326.101504947
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	IJPROWBQSHRNDZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.85
Topological Polar Surface Area	99.41
Polarizability	33.68
Ring Count	3
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	765899-28-3		$38.22-$137.59$38.22$55.04$89.43$137.59