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1-(3-fluorophenyl)-3-(3-{[7-(2-methyl-1H-imidazol-4-yl)quinazolin-4-yl]amino}phenyl)urea

1-(3-fluorophenyl)-3-(3-{[7-(2-methyl-1H-imidazol-4-yl)quinazolin-4-yl]amino}phenyl)urea

Formula: C25H20FN7O

SMILES: CC1=NC(=CN1)C1=CC2=NC=NC(NC3=CC(NC(=O)NC4=CC(F)=CC=C4)=CC=C3)=C2C=C1

IUPAC: 1-(3-fluorophenyl)-3-(3-{[7-(2-methyl-1H-imidazol-4-yl)quinazolin-4-yl]amino}phenyl)urea

InChI: InChI=1S/C25H20FN7O/c1-15-27-13-23(30-15)16-8-9-21-22(10-16)28-14-29-24(21)31-19-6-3-7-20(12-19)33-25(34)32-18-5-2-4-17(26)11-18/h2-14H,1H3,(H,27,30)(H,28,29,31)(H2,32,33,34)

Composition: C (66.22%), H (4.45%), F (4.19%), N (21.62%), O (3.53%)

Molar Mass: 453.481

Atom Count: 54

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 5
Asymmetric Atom Count 0
Exact Mass 453.171336455
Formal Charge 0
FSP3 0.04
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 4
InChIKey ICOOWHBBDIDHGV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 129.97
Topological Polar Surface Area 107.62
Polarizability 49.71
Ring Count 5
Rotatable Bond Count 5

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Purity (%)
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Packet Size
Selleck Chemicals
Purity LeadTime Formula UnitPrice
98% <10 Days C25H20FN7O Quote Only