Primary Record
CHEMBL5926851
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 86293039
- SMILES
- CC(C#N)OC1=NN=C(C=C1)C(C2=C(C=C(C(=C2)C3=NC=NC4=C3C=CC(=C4)N5CCOCC5)F)Cl)O
- Canonical SMILES
- CC(C#N)Oc1ccc(C(O)c2cc(-c3ncnc4cc(N5CCOCC5)ccc34)c(F)cc2Cl)nn1
Names & Synonyms
- CHEMBL5926851
- SCHEMBL17602427
- SCHEMBL29605795
- BDBM315676
- US10172859, Example 101
- US10172859, Example 102
- US10172859, Example 103
- US10172859, Example 104
- 2-(6-{[2-Chloro-4- fluoro-5-(7- morpholin-4-yl- quinazolin-4-yl)- phenyl]hydroxy- methyl}pyridazin-3- yloxy)propionitrile1H NMR (500 MHz, DMSO-d6) ppm = 9.12 (d,J = 2.7, 1H), 7.93 (dd, J = 11.2, 7.7, 1H), 7.84 (dd,J = 16.3, 9.2, 1H), 7.70-7.65 (m, 1H), 7.63-7.57 (m, 1H), 7.57-7.51 (m, 1H), 7.38 (dd,J = 9.1, 3.5, 1H), 7.21 (d, J = 2.4, 1H), 6.71 (dd,J = 10.3, 5.0, 1H), 6.28 (dd, J = 9.5, 5.0, 1H), 5.95-5.87 (m, 1H), 3.81-3.74 (m, 4H), 3.48-3.42(m, 4H), 1.76-1.70 (m, 3H)