Home Other Building Blocks 5-[(4,5-DICHLOROIMIDAZOL-1-YL)METHYL]-4-METHYL-1,2,4-TRIZOLE-3-THIOL

5-[(4,5-DICHLOROIMIDAZOL-1-YL)METHYL]-4-METHYL-1,2,4-TRIZOLE-3-THIOL

CAS No.:
175202-31-0
Catalog Number:
AG00AKCP
Molecular Formula:
C7H7Cl2N5S
Molecular Weight:
264.1350
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$160
- +
1g
1 week
United States
$405
- +
Product Description
Catalog Number:
AG00AKCP
Chemical Name:
5-[(4,5-DICHLOROIMIDAZOL-1-YL)METHYL]-4-METHYL-1,2,4-TRIZOLE-3-THIOL
CAS Number:
175202-31-0
Molecular Formula:
C7H7Cl2N5S
Molecular Weight:
264.1350
MDL Number:
MFCD00084995
IUPAC Name:
3-[(4,5-dichloroimidazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C7H7Cl2N5S/c1-13-4(11-12-7(13)15)2-14-3-10-5(8)6(14)9/h3H,2H2,1H3,(H,12,15)
InChI Key:
JIFYHCAKBJLMHL-UHFFFAOYSA-N
SMILES:
Clc1ncn(c1Cl)Cc1nnc(n1C)S
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.98g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.128g/mol
Monoisotopic Mass:
262.98g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties