Home Aminos 2-amino-5-(benzylsulfanyl)benzamide

2-amino-5-(benzylsulfanyl)benzamide

CAS No.:
1304873-04-8
Catalog Number:
AG01BBNH
Molecular Formula:
C14H14N2OS
Molecular Weight:
258.3388
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Product Description
Catalog Number:
AG01BBNH
Chemical Name:
2-amino-5-(benzylsulfanyl)benzamide
CAS Number:
1304873-04-8
Molecular Formula:
C14H14N2OS
Molecular Weight:
258.3388
MDL Number:
MFCD13436528
IUPAC Name:
2-amino-5-benzylsulfanylbenzamide
InChI:
InChI=1S/C14H14N2OS/c15-13-7-6-11(8-12(13)14(16)17)18-9-10-4-2-1-3-5-10/h1-8H,9,15H2,(H2,16,17)
InChI Key:
PJHQNJUROXSRPE-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(SCc2ccccc2)ccc1N
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.083g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.339g/mol
Monoisotopic Mass:
258.083g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties