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5-fluoro-2-{2-[(2-methoxy-3-methylphenyl)methyl]diazen-1-yl}-4-(pyrrolidin-1-yl)pyrimidine

5-fluoro-2-{2-[(2-methoxy-3-methylphenyl)methyl]diazen-1-yl}-4-(pyrrolidin-1-yl)pyrimidine

Formula: C17H20FN5O

SMILES: COC1=C(CN=NC2=NC=C(F)C(=N2)N2CCCC2)C=CC=C1C

IUPAC: 5-fluoro-2-{2-[(2-methoxy-3-methylphenyl)methyl]diazen-1-yl}-4-(pyrrolidin-1-yl)pyrimidine

InChI: InChI=1S/C17H20FN5O/c1-12-6-5-7-13(15(12)24-2)10-20-22-17-19-11-14(18)16(21-17)23-8-3-4-9-23/h5-7,11H,3-4,8-10H2,1-2H3

Composition: C (61.99%), H (6.12%), F (5.77%), N (21.26%), O (4.86%)

Molar Mass: 329.379

Atom Count: 44

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 329.165188447
Formal Charge 0
FSP3 0.41
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey ZYMNQZYXFPREJP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 93.81
Topological Polar Surface Area 62.97
Polarizability 33.41
Ring Count 3
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H20FN5O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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