Home Aminos 4-(ethylamino)quinazoline-2-thiol

4-(ethylamino)quinazoline-2-thiol

CAS No.:
147408-62-6
Catalog Number:
AG019OQQ
Molecular Formula:
C10H11N3S
Molecular Weight:
205.2794
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Product Description
Catalog Number:
AG019OQQ
Chemical Name:
4-(ethylamino)quinazoline-2-thiol
CAS Number:
147408-62-6
Molecular Formula:
C10H11N3S
Molecular Weight:
205.2794
MDL Number:
MFCD07366432
IUPAC Name:
4-(ethylamino)-1H-quinazoline-2-thione
InChI:
InChI=1S/C10H11N3S/c1-2-11-9-7-5-3-4-6-8(7)12-10(14)13-9/h3-6H,2H2,1H3,(H2,11,12,13,14)
InChI Key:
LUTLRQRICULTRC-UHFFFAOYSA-N
SMILES:
CCNc1nc(S)nc2c1cccc2
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.279g/mol
Monoisotopic Mass:
205.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
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