chempirical

7-Methoxy-6-(3-morpholinopropoxy)-3,4-dihydroquinazolin-4-one

C16H21N3O4CAS 199327-61-2319.36 g/mol

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ONNOHONO
EtherPhenolTertiary amine

Properties

Molecular formula
C16H21N3O4
Molar mass
319.36 g/mol
Exact mass
319.1532 Da
Melting point
233–236 °C
logP
1.45Crippen estimate
Polar surface area
76.9 Ų
H-bond donors / acceptors
1 / 7
Rotatable bonds
6

Identifiers

CAS number
199327-61-2
SMILES
COc1cc2ncnc(O)c2cc1OCCCN1CCOCC1
InChIKey
WFUBWLXSYCFZEH-UHFFFAOYSA-N
InChI
InChI=1S/C16H21N3O4/c1-21-14-10-13-12(16(20)18-11-17-13)9-15(14)23-6-2-3-19-4-7-22-8-5-19/h9-11H,2-8H2,1H3,(H,17,18,20)

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Names and synonyms

6 names
  • 4(3H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]-
  • 4(1H)-Quinazolinone, 7-methoxy-6-[3-(4-morpholinyl)propoxy]-
  • 7-Methoxy-6-[3-(4-morpholinyl)propoxy]-4(3H)-quinazolinone
  • 7-Methoxy-6-(3-(morpholin-4-yl)propoxy)-3H-quinazolin-4-one
  • 7-Methoxy-6-[3-(4-morpholinyl)propoxy]quinazolin-4(3H)-one
  • 7-Methoxy-6-(3-morpholinopropoxy)quinazolin-4-one

Work with 7-Methoxy-6-(3-morpholinopropoxy)-3,4-dihydroquinazolin-4-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6,7-Bis(2-methoxyethoxy)quinazolin-4(3H)-one179688-29-059 % similar Gefitinib184475-35-256 % similar 6-Hydroxy-7-methoxy-4(3H)-quinazolinone179688-52-952 % similar Cediranib288383-20-047 % similar Tandutinib387867-13-243 % similar 4-Methoxy-5-[3-(4-morpholinyl)propoxy]-2-nitrobenzonitrile675126-26-842 % similar 4-Chloro-6,7-bis(2-methoxyethoxy)quinazoline183322-18-141 % similar 6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione28888-44-040 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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