2-Methylpropyl 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate

HCID 29504

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Basic information

CAS: 19216-55-8
Standard SMILES: COc1cc2nc(N3CCN(C(=O)OCC(C)C)CC3)nc(N)c2cc1OC
InChIKey: UMGYFFDFGKMPGH-UHFFFAOYSA-N
Molecular formula: C19H27N5O4
Average molar mass: 389.4 g/mol
Monoisotopic mass: 389.20630436

Names & identifiers

Preferred name: 2-Methylpropyl 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate
IUPAC: 2-methylpropyl 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate

Names & synonyms

CYZ88J9LRT2-methylpropyl 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carboxylate19216-55-81-Piperazinecarboxylic acid, 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-, isobutyl ester2-Methylpropyl 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinecarboxylate1-Piperazinecarboxylic acid, 4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-, 2-methylpropyl ester

Database identifiers

CAS: 19216-55-8
PubChem CID: 29504
UNII: CYZ88J9LRT

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 103 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 6
Heavy atoms: 28
Formal charge: 0
Complexity: 515

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