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23515-33-5

23515-33-5 | 2H-1,3,5-Thiadiazine-2-thione, 3-(4-bromo-3-chlorophenyl)tetrahydro-5-methyl-

CAS No: 23515-33-5 Catalog No: AG002NIU MDL No:

Product Description

Catalog Number:
AG002NIU
Chemical Name:
2H-1,3,5-Thiadiazine-2-thione, 3-(4-bromo-3-chlorophenyl)tetrahydro-5-methyl-
CAS Number:
23515-33-5
Molecular Formula:
C10H10BrClN2S2
Molecular Weight:
337.6868
IUPAC Name:
3-(4-bromo-3-chlorophenyl)-5-methyl-1,3,5-thiadiazinane-2-thione
InChI:
InChI=1S/C10H10BrClN2S2/c1-13-5-14(10(15)16-6-13)7-2-3-8(11)9(12)4-7/h2-4H,5-6H2,1H3
InChI Key:
PGAXVYLXOUBGJB-UHFFFAOYSA-N
SMILES:
CN1CSC(=S)N(C1)c1ccc(c(c1)Cl)Br

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.916g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.678g/mol
Monoisotopic Mass:
335.916g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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