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154323-99-6 | 2-(2-THIENYL)-1,3-THIAZOLE-4-CARBOHYDRAZIDE
CAS No: 154323-99-6 Catalog No: AG00AMQE MDL No:MFCD02090451
Product Description
Catalog Number:
AG00AMQE
Chemical Name:
2-(2-THIENYL)-1,3-THIAZOLE-4-CARBOHYDRAZIDE
CAS Number:
154323-99-6
Molecular Formula:
C8H7N3OS2
Molecular Weight:
225.2907
MDL Number:
MFCD02090451
IUPAC Name:
2-thiophen-2-yl-1,3-thiazole-4-carbohydrazide
InChI:
InChI=1S/C8H7N3OS2/c9-11-7(12)5-4-14-8(10-5)6-2-1-3-13-6/h1-4H,9H2,(H,11,12)
InChI Key:
UHTMEFBCYDRAQK-UHFFFAOYSA-N
SMILES:
NNC(=O)c1csc(n1)c1cccs1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.003g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.284g/mol
Monoisotopic Mass:
225.003g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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