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1265848-98-3 | 4(3H)-Quinazolinone, 7-(4-morpholinyl)-
CAS No: 1265848-98-3 Catalog No: AG000SYJ MDL No:MFCD23160779
Product Description
Catalog Number:
AG000SYJ
Chemical Name:
4(3H)-Quinazolinone, 7-(4-morpholinyl)-
CAS Number:
1265848-98-3
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
MDL Number:
MFCD23160779
IUPAC Name:
7-morpholin-4-yl-3H-quinazolin-4-one
InChI:
InChI=1S/C12H13N3O2/c16-12-10-2-1-9(7-11(10)13-8-14-12)15-3-5-17-6-4-15/h1-2,7-8H,3-6H2,(H,13,14,16)
InChI Key:
NBTYLMFLZWTFJP-UHFFFAOYSA-N
SMILES:
O=c1[nH]cnc2c1ccc(c2)N1CCOCC1
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.255g/mol
Monoisotopic Mass:
231.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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