Home Other Building Blocks 5,10-dithia-3-azatricyclo[7.3.0.0,2,6]dodeca-1(9),2(6),3,11-tetraen-4-amine

5,10-dithia-3-azatricyclo[7.3.0.0,2,6]dodeca-1(9),2(6),3,11-tetraen-4-amine

CAS No.:
376349-95-0
Catalog Number:
AG01BJ0U
Molecular Formula:
C9H8N2S2
Molecular Weight:
208.3032
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Product Description
Catalog Number:
AG01BJ0U
Chemical Name:
5,10-dithia-3-azatricyclo[7.3.0.0,2,6]dodeca-1(9),2(6),3,11-tetraen-4-amine
CAS Number:
376349-95-0
Molecular Formula:
C9H8N2S2
Molecular Weight:
208.3032
MDL Number:
MFCD17232974
IUPAC Name:
4,5-dihydrothieno[3,2-e][1,3]benzothiazol-2-amine
InChI:
InChI=1S/C9H8N2S2/c10-9-11-8-5-3-4-12-6(5)1-2-7(8)13-9/h3-4H,1-2H2,(H2,10,11)
InChI Key:
OJUDYDLEOMQXLM-UHFFFAOYSA-N
SMILES:
Nc1sc2c(n1)c1ccsc1CC2
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.297g/mol
Monoisotopic Mass:
208.013g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties