200,000+ products from a single source!
sales@angenechem.com
87411-03-8 | 1,3,4-Thiadiazol-2-amine, 5-[4-(2-methylphenoxy)butyl]-
CAS No: 87411-03-8 Catalog No: AG004GEZ MDL No:
Product Description
Catalog Number:
AG004GEZ
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-[4-(2-methylphenoxy)butyl]-
CAS Number:
87411-03-8
Molecular Formula:
C13H17N3OS
Molecular Weight:
263.3586
IUPAC Name:
5-[4-(2-methylphenoxy)butyl]-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C13H17N3OS/c1-10-6-2-3-7-11(10)17-9-5-4-8-12-15-16-13(14)18-12/h2-3,6-7H,4-5,8-9H2,1H3,(H2,14,16)
InChI Key:
WGXNKYWSYWRVFP-UHFFFAOYSA-N
SMILES:
Nc1nnc(s1)CCCCOc1ccccc1C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.109g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.359g/mol
Monoisotopic Mass:
263.109g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.