200,000+ products from a single source!
sales@angenechem.com
117457-82-6 | 3-Furancarboxamide, N-[[[4-(diethylamino)phenyl]amino]thioxomethyl]-5-nitro-
CAS No: 117457-82-6 Catalog No: AG000EBT MDL No:
Product Description
Catalog Number:
AG000EBT
Chemical Name:
3-Furancarboxamide, N-[[[4-(diethylamino)phenyl]amino]thioxomethyl]-5-nitro-
CAS Number:
117457-82-6
Molecular Formula:
C16H18N4O4S
Molecular Weight:
362.4035
IUPAC Name:
N-[[4-(diethylamino)phenyl]carbamothioyl]-5-nitrofuran-3-carboxamide
InChI:
InChI=1S/C16H18N4O4S/c1-3-19(4-2)13-7-5-12(6-8-13)17-16(25)18-15(21)11-9-14(20(22)23)24-10-11/h5-10H,3-4H2,1-2H3,(H2,17,18,21,25)
InChI Key:
GMYWYYUKBYJTQD-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)NC(=S)NC(=O)c1coc(c1)[N+](=O)[O-])CC
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.105g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
362.404g/mol
Monoisotopic Mass:
362.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.