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76781-42-5 | Quinazoline, 5,6,7,8-tetrahydro-4-(4-morpholinyl)-2-(1-piperazinyl)-
CAS No: 76781-42-5 Catalog No: AG005IBU MDL No:
Product Description
Catalog Number:
AG005IBU
Chemical Name:
Quinazoline, 5,6,7,8-tetrahydro-4-(4-morpholinyl)-2-(1-piperazinyl)-
CAS Number:
76781-42-5
Molecular Formula:
C16H25N5O
Molecular Weight:
303.4026
IUPAC Name:
4-(2-piperazin-1-yl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine
InChI:
InChI=1S/C16H25N5O/c1-2-4-14-13(3-1)15(20-9-11-22-12-10-20)19-16(18-14)21-7-5-17-6-8-21/h17H,1-12H2
InChI Key:
MAZUXSZWOQHVNU-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)c1nc2CCCCc2c(n1)N1CCOCC1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.206g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.41g/mol
Monoisotopic Mass:
303.206g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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