Home Aminos 5-[4-(Diethylamino)phenyl]-4-ethyl-4h-1,2,4-triazole-3-thiol

5-[4-(Diethylamino)phenyl]-4-ethyl-4h-1,2,4-triazole-3-thiol

CAS No.:
669748-44-1
Catalog Number:
AG00FANQ
Molecular Formula:
C14H20N4S
Molecular Weight:
276.4004
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00FANQ
Chemical Name:
5-[4-(Diethylamino)phenyl]-4-ethyl-4h-1,2,4-triazole-3-thiol
CAS Number:
669748-44-1
Molecular Formula:
C14H20N4S
Molecular Weight:
276.4004
MDL Number:
MFCD03900786
IUPAC Name:
3-[4-(diethylamino)phenyl]-4-ethyl-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C14H20N4S/c1-4-17(5-2)12-9-7-11(8-10-12)13-15-16-14(19)18(13)6-3/h7-10H,4-6H2,1-3H3,(H,16,19)
InChI Key:
BBTVQOOSFNMLMU-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)c1nnc(n1CC)S)CC
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.141g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.402g/mol
Monoisotopic Mass:
276.141g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties