1-[(2-Methoxynaphth-3-yl)aminocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine

HCID 23446299

Notes Reactions

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Basic information

Standard SMILES: COc1cc(OC)cc(N2CCN(C(=O)Nc3cc4ccccc4cc3OC)CC2)c1
InChIKey: LMVMEKBMEAFAMT-UHFFFAOYSA-N
Molecular formula: C24H27N3O4
Average molar mass: 421.5 g/mol

Names & identifiers

Preferred name: 1-[(2-Methoxynaphth-3-yl)aminocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine
IUPAC: 4-(3,5-dimethoxyphenyl)-N-(3-methoxynaphthalen-2-yl)piperazine-1-carboxamide

Names & synonyms

SCHEMBL6783151LMVMEKBMEAFAMT-UHFFFAOYSA-N1-[(2-Methoxynaphth-3-yl)aminocarbonyl]-4-(3,5-dimethoxyphenyl) piperazine1-[(2-Methoxynaphth-3-yl)aminocarbonyl]-4-(3,5-dimethoxyphenyl)piperazine

Database identifiers

PubChem CID: 23446299

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 63.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 31
Formal charge: 0
Complexity: 571

Related reactions

2 records

New reaction record

HRID 1841505As productuspto-grants-2004_01

HRID 2144123As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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