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N-(3-bromo-2-fluorophenyl)-7H,8H-[1,4]dioxino[2,3-g]quinazolin-4-amine

N-(3-bromo-2-fluorophenyl)-7H,8H-[1,4]dioxino[2,3-g]quinazolin-4-amine

CAS: 2305154-31-6

Formula: C16H11BrFN3O2

SMILES: FC1=C(Br)C=CC=C1NC1=NC=NC2=CC3=C(OCCO3)C=C12

IUPAC: N-(3-bromo-2-fluorophenyl)-7H,8H-[1,4]dioxino[2,3-g]quinazolin-4-amine

InChI: InChI=1S/C16H11BrFN3O2/c17-10-2-1-3-11(15(10)18)21-16-9-6-13-14(23-5-4-22-13)7-12(9)19-8-20-16/h1-3,6-8H,4-5H2,(H,19,20,21)

Composition: C (51.09%), H (2.95%), Br (21.24%), F (5.05%), N (11.17%), O (8.51%)

Molar Mass: 376.185

Atom Count: 34

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 375.001868
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey MTLUFWWVOINWEL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.4
Topological Polar Surface Area 56.27
Polarizability 33.57
Ring Count 4
Rotatable Bond Count 2

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Purity LeadTime CAS UnitPrice
98% <10 Days 2305154-31-6 Quote Only
Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 2305154-31-6 $114.66-$777.39$114.66$176.58$292.00$467.81$777.39
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