Home Other Building Blocks CarbaMiMidothioic acid, N,N'-dicyclohexyl-, (5,6-dihydro-6,6-diMethyliMidazo[2,1-b]thiazol-3-yl)Methyl ester, hydrochloride (1

CarbaMiMidothioic acid, N,N'-dicyclohexyl-, (5,6-dihydro-6,6-diMethyliMidazo[2,1-b]thiazol-3-yl)Methyl ester, hydrochloride (1

CAS No.:
1092776-63-0
Catalog Number:
AG0095XQ
Molecular Formula:
C21H36Cl2N4S2
Molecular Weight:
479.5733
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$198
- +
10mg
99%
1 week
United States
$307
- +
25mg
99%
1 week
United States
$557
- +
50mg
99%
1 week
United States
$957
- +
100mg
99%
1 week
United States
$1623
- +
Product Description
Catalog Number:
AG0095XQ
Chemical Name:
CarbaMiMidothioic acid, N,N'-dicyclohexyl-, (5,6-dihydro-6,6-diMethyliMidazo[2,1-b]thiazol-3-yl)Methyl ester, hydrochloride (1
CAS Number:
1092776-63-0
Molecular Formula:
C21H36Cl2N4S2
Molecular Weight:
479.5733
MDL Number:
MFCD22683853
IUPAC Name:
(6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazol-3-yl)methyl N,N'-dicyclohexylcarbamimidothioate;dihydrochloride
InChI:
InChI=1S/C21H34N4S2.2ClH/c1-21(2)15-25-18(14-27-20(25)24-21)13-26-19(22-16-9-5-3-6-10-16)23-17-11-7-4-8-12-17;;/h14,16-17H,3-13,15H2,1-2H3,(H,22,23);2*1H
InChI Key:
HFXJOXOIINQOEB-UHFFFAOYSA-N
SMILES:
CC1(C)N=c2n(C1)c(cs2)CS/C(=N\C1CCCCC1)/NC1CCCCC1.Cl.Cl
Properties
Complexity:
614  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
478.176g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
479.567g/mol
Monoisotopic Mass:
478.176g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties