200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 675104-36-6

675104-36-6

675104-36-6 | N1-(2-CHLOROPHENYL)-2-{2-[(2-NITROPHENYL)THIO]ACETYL}HYDRAZINE-1-CARBOTHIOAMIDE

CAS No: 675104-36-6 Catalog No: AG006G3U MDL No:MFCD00097061

Product Description

Catalog Number:
AG006G3U
Chemical Name:
N1-(2-CHLOROPHENYL)-2-{2-[(2-NITROPHENYL)THIO]ACETYL}HYDRAZINE-1-CARBOTHIOAMIDE
CAS Number:
675104-36-6
Molecular Formula:
C15H13ClN4O3S2
Molecular Weight:
396.8717
MDL Number:
MFCD00097061
IUPAC Name:
1-(2-chlorophenyl)-3-[[2-(2-nitrophenyl)sulfanylacetyl]amino]thiourea
InChI:
InChI=1S/C15H13ClN4O3S2/c16-10-5-1-2-6-11(10)17-15(24)19-18-14(21)9-25-13-8-4-3-7-12(13)20(22)23/h1-8H,9H2,(H,18,21)(H2,17,19,24)
InChI Key:
GLNDLPYJMUWKAJ-UHFFFAOYSA-N
SMILES:
O=C(CSc1ccccc1[N+](=O)[O-])NNC(=S)Nc1ccccc1Cl

Properties

Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.012g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
396.864g/mol
Monoisotopic Mass:
396.012g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
156A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

Related Products

© 2019 Angene International Limited. All rights Reserved.