Home Other Building Blocks 2-(furan-2-yl)quinazoline-4-thiol

2-(furan-2-yl)quinazoline-4-thiol

CAS No.:
923853-12-7
Catalog Number:
AG019K5S
Molecular Formula:
C12H8N2OS
Molecular Weight:
228.2697
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Product Description
Catalog Number:
AG019K5S
Chemical Name:
2-(furan-2-yl)quinazoline-4-thiol
CAS Number:
923853-12-7
Molecular Formula:
C12H8N2OS
Molecular Weight:
228.2697
MDL Number:
MFCD08444442
IUPAC Name:
2-(furan-2-yl)-1H-quinazoline-4-thione
InChI:
InChI=1S/C12H8N2OS/c16-12-8-4-1-2-5-9(8)13-11(14-12)10-6-3-7-15-10/h1-7H,(H,13,14,16)
InChI Key:
DRNQQXJMZSKYFQ-UHFFFAOYSA-N
SMILES:
Sc1nc(nc2c1cccc2)c1ccco1
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.036g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.269g/mol
Monoisotopic Mass:
228.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties