Home Aminos 2-[(quinazolin-4-yl)amino]ethan-1-ol

2-[(quinazolin-4-yl)amino]ethan-1-ol

CAS No.:
5423-59-6
Catalog Number:
AG019SRG
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
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Product Description
Catalog Number:
AG019SRG
Chemical Name:
2-[(quinazolin-4-yl)amino]ethan-1-ol
CAS Number:
5423-59-6
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD00994941
IUPAC Name:
2-(quinazolin-4-ylamino)ethanol
InChI:
InChI=1S/C10H11N3O/c14-6-5-11-10-8-3-1-2-4-9(8)12-7-13-10/h1-4,7,14H,5-6H2,(H,11,12,13)
InChI Key:
CHGHRZZPHNOWQV-UHFFFAOYSA-N
SMILES:
OCCNc1ncnc2c1cccc2
NSC Number:
13215
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties