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75913-03-0 | 6-Quinazolinecarboxylicacid, 3-(2-chlorophenyl)-3,4-dihydro-2,5,7-trimethyl-4-oxo-, ethyl ester
CAS No: 75913-03-0 Catalog No: AG005HCG MDL No:
Product Description
Catalog Number:
AG005HCG
Chemical Name:
6-Quinazolinecarboxylicacid, 3-(2-chlorophenyl)-3,4-dihydro-2,5,7-trimethyl-4-oxo-, ethyl ester
CAS Number:
75913-03-0
Molecular Formula:
C20H19ClN2O3
Molecular Weight:
370.8295
IUPAC Name:
ethyl 3-(2-chlorophenyl)-2,5,7-trimethyl-4-oxoquinazoline-6-carboxylate
InChI:
InChI=1S/C20H19ClN2O3/c1-5-26-20(25)17-11(2)10-15-18(12(17)3)19(24)23(13(4)22-15)16-9-7-6-8-14(16)21/h6-10H,5H2,1-4H3
InChI Key:
JGICPIBJMZIJOF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(C)cc2c(c1C)c(=O)n(c(n2)C)c1ccccc1Cl
Properties
Complexity:
594
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.108g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.833g/mol
Monoisotopic Mass:
370.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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