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19801-37-7 | 6H-Pyrimido[2,1-b]quinazolin-6-one, 2,3,4,11-tetrahydro-
CAS No: 19801-37-7 Catalog No: AG002B83 MDL No:MFCD01759147
Product Description
Catalog Number:
AG002B83
Chemical Name:
6H-Pyrimido[2,1-b]quinazolin-6-one, 2,3,4,11-tetrahydro-
CAS Number:
19801-37-7
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
MDL Number:
MFCD01759147
IUPAC Name:
1,2,3,4-tetrahydropyrimido[2,1-b]quinazolin-6-one
InChI:
InChI=1S/C11H11N3O/c15-10-8-4-1-2-5-9(8)13-11-12-6-3-7-14(10)11/h1-2,4-5H,3,6-7H2,(H,12,13)
InChI Key:
YBDKSPSOTVXJEP-UHFFFAOYSA-N
SMILES:
O=c1c2ccccc2[nH]c2=NCCCn12
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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