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Vatalanib diHCl
SpectraBase Compound ID 9EtPoCEBmkW
InChI InChI=1S/C20H15ClN4.2ClH/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14;;/h1-12H,13H2,(H,23,25);2*1H
InChIKey AZUQEHCMDUSRLH-UHFFFAOYSA-N
Mol Weight 419.74 g/mol
Molecular Formula C20H17Cl3N4
Exact Mass 418.05188 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3w3i7bL9YBm
Name Vatalanib dihydrochloride
Source of Sample Cayman Chemical Company
Catalog Number 14868
Lot Number 0452599-5
CAS Registry Number 212141-54-3
Classification antagonist of the VEGF receptors
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Formula C20H17Cl3N4
IUPAC Name N-(4-Chlorophenyl)-4-(4-pyridinylmethyl)-1-phthalazinamine, dihydrochloride
InChI InChI=1S/C20H15ClN4.2ClH/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14;;/h1-12H,13H2,(H,23,25);2*1H
InChIKey AZUQEHCMDUSRLH-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES N(c1nnc(c2ccccc12)Cc1ccncc1)c1ccc(cc1)Cl.Cl.Cl
Source of Spectrum Forensic Spectral Research
Synonyms CGP 79787; PTK787; PTK/ZK; Vatalanib diHCl
Technique KBr0