Organofluorine / Alfa Chemistry
AZD-1480

AZD-1480

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AZD-1480
Catalog OFC935666889
CAS 935666-88-9
Category Fluorinated APIs
Synonyms UNII-KL2Z2TLF01; AZD 1480; AZD1480; 5-chloro-2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
Purity 98%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 5-chloro-2-N-[(1S)-1-(5-fluoropyrimidin-2-yl)ethyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
InChI InChI=1S/C14H14ClFN8/c1-7-3-11(24-23-7)21-13-10(15)6-19-14(22-13)20-8(2)12-17-4-9(16)5-18-12/h3-6,8H,1-2H3,(H3,19,20,21,22,23,24)/t8-/m0/s1
InChI Key PDOQBOJDRPLBQU-QMMMGPOBSA-N
Isomeric SMILES CC1=CC(=NN1)NC2=NC(=NC=C2Cl)N[C@@H](C)C3=NC=C(C=N3)F
EC Number 641-076-0
Molecular Formula C14H14ClFN8
Molecular Weight 348.77
Density 1.517 g/cm3
XLogP3-AA 2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 348.1013983 g/mol
Monoisotopic Mass 348.1013983 g/mol
Topological Polar Surface Area 104Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 397

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