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122229-01-0 | 4(3H)-Quinazolinone, 2-ethyl-3-pentyl-
CAS No: 122229-01-0 Catalog No: AG0016YI MDL No:
Product Description
Catalog Number:
AG0016YI
Chemical Name:
4(3H)-Quinazolinone, 2-ethyl-3-pentyl-
CAS Number:
122229-01-0
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
IUPAC Name:
2-ethyl-3-pentylquinazolin-4-one
InChI:
InChI=1S/C15H20N2O/c1-3-5-8-11-17-14(4-2)16-13-10-7-6-9-12(13)15(17)18/h6-7,9-10H,3-5,8,11H2,1-2H3
InChI Key:
QRFKUDDRZZYPPR-UHFFFAOYSA-N
SMILES:
CCCCCn1c(CC)nc2c(c1=O)cccc2
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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