200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 332377-28-3
332377-28-3 | 2-[5-(3-Hydroxy-naphthalen-2-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-N-(4-nitro-phenyl)-acetamide
CAS No: 332377-28-3 Catalog No: AG01EV9C MDL No:
Product Description
Catalog Number:
AG01EV9C
Chemical Name:
2-[5-(3-Hydroxy-naphthalen-2-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-N-(4-nitro-phenyl)-acetamide
CAS Number:
332377-28-3
Molecular Formula:
C20H14N4O5S
Molecular Weight:
422.4140
IUPAC Name:
2-[[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)acetamide
InChI:
InChI=1S/C20H14N4O5S/c25-17-10-13-4-2-1-3-12(13)9-16(17)19-22-23-20(29-19)30-11-18(26)21-14-5-7-15(8-6-14)24(27)28/h1-10,25H,11H2,(H,21,26)
InChI Key:
CGBLFQTZJRJTPC-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nnc(o1)c1cc2ccccc2cc1O
Properties
Complexity:
613
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.068g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
422.415g/mol
Monoisotopic Mass:
422.068g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
159A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.