200,000+ products from a single source!
sales@angenechem.com
81921-84-8 | 1,3,4-Thiadiazolium,5-[bis(1-methylethyl)amino]-2-[2-[4-(dimethylamino)phenyl]diazenyl]-3-methyl-,chloride (1:1)
CAS No: 81921-84-8 Catalog No: AG0055WA MDL No:
Product Description
Catalog Number:
AG0055WA
Chemical Name:
1,3,4-Thiadiazolium,5-[bis(1-methylethyl)amino]-2-[2-[4-(dimethylamino)phenyl]diazenyl]-3-methyl-,chloride (1:1)
CAS Number:
81921-84-8
Molecular Formula:
C17H27ClN6S
Molecular Weight:
382.9545
IUPAC Name:
5-[[4-(dimethylamino)phenyl]diazenyl]-4-methyl-N,N-di(propan-2-yl)-1,3,4-thiadiazol-4-ium-2-amine;chloride
InChI:
InChI=1S/C17H27N6S.ClH/c1-12(2)23(13(3)4)17-20-22(7)16(24-17)19-18-14-8-10-15(11-9-14)21(5)6;/h8-13H,1-7H3;1H/q+1;/p-1
InChI Key:
JHYFBHDSJIWJDE-UHFFFAOYSA-M
SMILES:
CN(c1ccc(cc1)N=Nc1sc(n[n+]1C)N(C(C)C)C(C)C)C.[Cl-]
EC Number:
279-852-2
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.171g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.955g/mol
Monoisotopic Mass:
382.171g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.