Morpholine, 4-(4-((6-methyl-2-(3,4,5-trimethoxyphenyl)-4-pyrimidinyl)amino)benzoyl)-

HCID 3043891

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Basic information

CAS: 56302-83-1
Standard SMILES: COc1cc(-c2nc(C)cc(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)cc(OC)c1OC
InChIKey: JMWCYVHRHTXAHC-UHFFFAOYSA-N
Molecular formula: C25H28N4O5
Average molar mass: 464.5 g/mol
Monoisotopic mass: 464.20597001

Names & identifiers

Preferred name: Morpholine, 4-(4-((6-methyl-2-(3,4,5-trimethoxyphenyl)-4-pyrimidinyl)amino)benzoyl)-
IUPAC: [4-[[6-methyl-2-(3,4,5-trimethoxyphenyl)pyrimidin-4-yl]amino]phenyl]-morpholin-4-ylmethanone

Names & synonyms

Morpholine, 4-(4-((6-methyl-2-(3,4,5-trimethoxyphenyl)-4-pyrimidinyl)amino)benzoyl)-4-(4-((6-Methyl-2-(3,4,5-trimethoxyphenyl)-4-pyrimidinyl)amino)benzoyl)morpholine56302-83-1DTXSID802048472-(3',4',5'-Trimethoxyphenyl)-4-(para-morpholinocarbonylphenylamino)-6-pyrimidineRefChem:357785DTXCID10127338(4-{[6-Methyl-2-(3,4,5-trimethoxyphenyl)pyrimidin-4-yl]amino}phenyl)(morpholin-4-yl)methanone

Database identifiers

CAS: 56302-83-1
PubChem CID: 3043891
DTXSID: DTXSID80204847

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 95 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 7
Heavy atoms: 34
Formal charge: 0
Complexity: 627

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