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30480-73-0 | 4H-1,3-Thiazin-2-amine, 5,6-dihydro-N-(phenylmethyl)-
CAS No: 30480-73-0 Catalog No: AG00309B MDL No:MFCD03152618
Product Description
Catalog Number:
AG00309B
Chemical Name:
4H-1,3-Thiazin-2-amine, 5,6-dihydro-N-(phenylmethyl)-
CAS Number:
30480-73-0
Molecular Formula:
C11H14N2S
Molecular Weight:
206.3073
MDL Number:
MFCD03152618
IUPAC Name:
N-benzyl-5,6-dihydro-4H-1,3-thiazin-2-amine
InChI:
InChI=1S/C11H14N2S/c1-2-5-10(6-3-1)9-13-11-12-7-4-8-14-11/h1-3,5-6H,4,7-9H2,(H,12,13)
InChI Key:
KVFOICMSGAUPBK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CNC1=NCCCS1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.088g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.307g/mol
Monoisotopic Mass:
206.088g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
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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