Home Other Building Blocks 1,3-bis(phenylimino)thiourea

1,3-bis(phenylimino)thiourea

CAS No.:
23216-42-4
Catalog Number:
AG01AKRI
Molecular Formula:
C13H10N4S
Molecular Weight:
254.3103
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Product Description
Catalog Number:
AG01AKRI
Chemical Name:
1,3-bis(phenylimino)thiourea
CAS Number:
23216-42-4
Molecular Formula:
C13H10N4S
Molecular Weight:
254.3103
MDL Number:
MFCD01070443
IUPAC Name:
1,3-bis(phenylimino)thiourea
InChI:
InChI=1S/C13H10N4S/c18-13(16-14-11-7-3-1-4-8-11)17-15-12-9-5-2-6-10-12/h1-10H
InChI Key:
GWJXGGNBNZFXMM-UHFFFAOYSA-N
SMILES:
S=C(N=Nc1ccccc1)N=Nc1ccccc1
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.063g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.311g/mol
Monoisotopic Mass:
254.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties