2-(3-(4-(1H-Indazol-5-ylamino)-2-quinazolinyl)phenoxy)-N-(1-methylethyl)acetamide

C₂₆H₂₄N₆O₂CAS 911417-87-3452.52 g/mol

Open in Covalent MOL file

Ether Secondary amine

Properties

Molecular formula: C₂₆H₂₄N₆O₂
Molar mass: 452.52 g/mol
Exact mass: 452.1961 Da
logP: 5.66Crippen estimate
Polar surface area: 108.3 Å²
H-bond donors / acceptors: 3 / 6
Rotatable bonds: 7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

911417-87-3

SMILES

CC(C)N=C(O)COc1cccc(-c2nc(Nc3ccc4n[nH]cc4c3)c3ccccc3n2)c1

InChIKey

GKHIVNAUVKXIIY-UHFFFAOYSA-N

InChI

InChI=1S/C26H24N6O2/c1-16(2)28-24(33)15-34-20-7-5-6-17(13-20)25-30-23-9-4-3-8-21(23)26(31-25)29-19-10-11-22-18(12-19)14-27-32-22/h3-14,16H,15H2,1-2H3,(H,27,32)(H,28,33)(H,29,30,31)

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Names and synonyms

8 names

2-[3-[4-(1H-Indazol-5-ylamino)-2-quinazolinyl]phenoxy]-N-(1-methylethyl)acetamide
Acetamide, 2-[3-[4-(1H-indazol-5-ylamino)-2-quinazolinyl]phenoxy]-N-(1-methylethyl)-
2-[3-[4-[(1H-Indazol-5-yl)amino]quinazolin-2-yl]phenoxy]-N-isopropylacetamide
SLx 2119
KD 025
Belumosudil
2-{3-[4-(1H-Indazol-5-ylamino)quinazolin-2-yl]phenoxy}-N-(propan-2-yl)acetamide
2-[3-[4-(1H-Indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-propan-2-ylacetamide

Work with 2-(3-(4-(1H-Indazol-5-ylamino)-2-quinazolinyl)phenoxy)-N-(1-methylethyl)acetamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Elsewhere

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