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76781-43-6 | Ethanol, 2-[[5,6,7,8-tetrahydro-2-(1-piperazinyl)-4-quinazolinyl]amino]-
CAS No: 76781-43-6 Catalog No: AG005IBT MDL No:
Product Description
Catalog Number:
AG005IBT
Chemical Name:
Ethanol, 2-[[5,6,7,8-tetrahydro-2-(1-piperazinyl)-4-quinazolinyl]amino]-
CAS Number:
76781-43-6
Molecular Formula:
C14H23N5O
Molecular Weight:
277.3653
IUPAC Name:
2-[(2-piperazin-1-yl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]ethanol
InChI:
InChI=1S/C14H23N5O/c20-10-7-16-13-11-3-1-2-4-12(11)17-14(18-13)19-8-5-15-6-9-19/h15,20H,1-10H2,(H,16,17,18)
InChI Key:
QGHBHEZGDBRQIM-UHFFFAOYSA-N
SMILES:
OCCNc1nc(nc2c1CCCC2)N1CCNCC1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.19g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
277.372g/mol
Monoisotopic Mass:
277.19g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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