200,000+ products from a single source!
sales@angenechem.com
18853-76-4 | Benzoxazole, 2,2'-(2,5-thiophenediyl)bis[5-(1-methylethyl)-
CAS No: 18853-76-4 Catalog No: AG007RKT MDL No:
Product Description
Catalog Number:
AG007RKT
Chemical Name:
Benzoxazole, 2,2'-(2,5-thiophenediyl)bis[5-(1-methylethyl)-
CAS Number:
18853-76-4
Molecular Formula:
C24H22N2O2S
Molecular Weight:
402.5087
IUPAC Name:
5-propan-2-yl-2-[5-(5-propan-2-yl-1,3-benzoxazol-2-yl)thiophen-2-yl]-1,3-benzoxazole
InChI:
InChI=1S/C24H22N2O2S/c1-13(2)15-5-7-19-17(11-15)25-23(27-19)21-9-10-22(29-21)24-26-18-12-16(14(3)4)6-8-20(18)28-24/h5-14H,1-4H3
InChI Key:
HVSFHJMMPSSZMH-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)nc(o2)c1ccc(s1)c1nc2c(o1)ccc(c2)C(C)C)C
Properties
Complexity:
525
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.14g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.512g/mol
Monoisotopic Mass:
402.14g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.