Ethyl 4-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperazine-1-carboxylate

HCID 390344

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Basic information

CAS: 106582-42-7
Standard SMILES: CCOC(=O)N1CCN(c2ccc3c(C)cc(C)nc3n2)CC1
InChIKey: AUQSTCJTZDZRNR-UHFFFAOYSA-N
Molecular formula: C17H22N4O2
Average molar mass: 314.4 g/mol
Monoisotopic mass: 314.17427596

Names & identifiers

Preferred name: Ethyl 4-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperazine-1-carboxylate
IUPAC: ethyl 4-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperazine-1-carboxylate

Names & synonyms

NSC687680ethyl 4-(5,7-dimethyl-1,8-naphthyridin-2-yl)piperazine-1-carboxylateCHEMBL2001805DTXSID901159300NSC-687680106582-42-7NCI60_031600Ethyl 4-(5,7-dimethyl-1,8-naphthyridin-2-yl)-1-piperazinecarboxylateEthyl 4-(5,7-dimethyl[1,8]naphthyridin-2-yl)-1-piperazinecarboxylate

Database identifiers

CAS: 106582-42-7
PubChem CID: 390344
DTXSID: DTXSID901159300
ChEMBL: CHEMBL2001805

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 58.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 23
Formal charge: 0
Complexity: 411

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