2H-1-Benzopyran-2-one, 7-methoxy-4-methyl-8-(3-(4-methyl-1-piperazinyl)propoxy)-

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Basic information

CAS: 148727-12-2
Standard SMILES: COc1ccc2c(C)cc(=O)oc2c1OCCCN1CCN(C)CC1
InChIKey: CGJFUXKXMRUYQD-UHFFFAOYSA-N
Molecular formula: C19H26N2O4
Average molar mass: 346.4 g/mol
Monoisotopic mass: 346.18925731

Names & identifiers

Preferred name: 2H-1-Benzopyran-2-one, 7-methoxy-4-methyl-8-(3-(4-methyl-1-piperazinyl)propoxy)-
IUPAC: 7-methoxy-4-methyl-8-[3-(4-methylpiperazin-1-yl)propoxy]chromen-2-one

Names & synonyms

2H-1-Benzopyran-2-one, 7-methoxy-4-methyl-8-(3-(4-methyl-1-piperazinyl)propoxy)-7-Methoxy-4-methyl-8-(3-(4-methyl-1-piperazinyl)propoxy)-2H-1-benzopyran-2-one148727-12-2DTXSID30164088RefChem:268249DTXCID80865797-Methoxy-4-methyl-8-[3-(4-methylpiperazin-1-yl)propoxy]-2H-1-benzopyran-2-one

Database identifiers

CAS: 148727-12-2
PubChem CID: 3073448
DTXSID: DTXSID30164088

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 51.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 25
Formal charge: 0
Complexity: 488

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Compound notes

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