Primary Record
CHEMBL6055613
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 86292656
- SMILES
- CCN1C(=O)C=CC(=N1)C(C2=C(C=C(C(=C2)C3=NC=NC4=C3C=CC(=C4)N5CCOCC5)F)Cl)O
- Canonical SMILES
- CCn1nc(C(O)c2cc(-c3ncnc4cc(N5CCOCC5)ccc34)c(F)cc2Cl)ccc1=O
Names & Synonyms
- CHEMBL6055613
- SCHEMBL16235421
- SCHEMBL29606724
- ROTFCYSSIJCDLR-UHFFFAOYSA-N
- BDBM315668
- US10172859, Example 93
- US10172859, Example 96
- US10172859, Example 97
- 6-{[2-Chloro-4-fluoro-5- (7-morpholin-4-yl- quinazolin-4-yl)phenyl]- hydroxymethyl}-2-ethyl- 2H-pyridazin-3-one1H NMR (500 MHz, DMSO-d6) ppm = 9.13 (s, 1H),7.94 (d, J = 7.7, 1H), 7.68 (d, J = 9.5, 1H), 7.59-7.52(m, 2H), 7.46 (d, J = 9.6, 1H), 7.22 (d, J = 2.3, 1H),6.92 (d, J = 9.6, 1H), 6.61 (d, J = 4.8, 1H), 5.90 (d,J = 4.8, 1H), 4.08-3.95 (m, 2H), 3.81-3.74 (m, 4H),3.49-3.41 (m, 4H), 1.20 (t, J = 7.2, 3H)
- 6-{[2-chloro-4-fluoro-5-(7-morpholin-4-ylquinazolin-4-yl)phenyl]hydroxymethyl}-2-ethyl-2H-pyridazin-3-one