200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 76892-42-7
76892-42-7 | Thiourea, N-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-N'-phenyl-
CAS No: 76892-42-7 Catalog No: AG005G4V MDL No:
Product Description
Catalog Number:
AG005G4V
Chemical Name:
Thiourea, N-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-N'-phenyl-
CAS Number:
76892-42-7
Molecular Formula:
C15H11N3O2S
Molecular Weight:
297.3317
IUPAC Name:
1-(1,3-dioxoisoindol-2-yl)-3-phenylthiourea
InChI:
InChI=1S/C15H11N3O2S/c19-13-11-8-4-5-9-12(11)14(20)18(13)17-15(21)16-10-6-2-1-3-7-10/h1-9H,(H2,16,17,21)
InChI Key:
MDYQQQZGCUBRCX-UHFFFAOYSA-N
SMILES:
S=C(NN1C(=O)c2c(C1=O)cccc2)Nc1ccccc1
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.057g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.332g/mol
Monoisotopic Mass:
297.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
93.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.