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125096-15-3 | 10H-Phenothiazine-10-acetic acid, hydrazide
CAS No: 125096-15-3 Catalog No: AG000N4E MDL No:MFCD01249325
Product Description
Catalog Number:
AG000N4E
Chemical Name:
10H-Phenothiazine-10-acetic acid, hydrazide
CAS Number:
125096-15-3
Molecular Formula:
C14H13N3OS
Molecular Weight:
271.3375
MDL Number:
MFCD01249325
IUPAC Name:
2-phenothiazin-10-ylacetohydrazide
InChI:
InChI=1S/C14H13N3OS/c15-16-14(18)9-17-10-5-1-3-7-12(10)19-13-8-4-2-6-11(13)17/h1-8H,9,15H2,(H,16,18)
InChI Key:
DGGWSYPHEPMOBE-UHFFFAOYSA-N
SMILES:
NNC(=O)CN1c2ccccc2Sc2c1cccc2
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.078g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.338g/mol
Monoisotopic Mass:
271.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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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