200,000+ products from a single source!
sales@angenechem.com
89721-75-5 | Urea, N-[4-(1,2-benzisothiazol-5-yloxy)phenyl]-N'-methyl-
CAS No: 89721-75-5 Catalog No: AG0042AQ MDL No:
Product Description
Catalog Number:
AG0042AQ
Chemical Name:
Urea, N-[4-(1,2-benzisothiazol-5-yloxy)phenyl]-N'-methyl-
CAS Number:
89721-75-5
Molecular Formula:
C15H13N3O2S
Molecular Weight:
299.3476
IUPAC Name:
1-[4-(1,2-benzothiazol-5-yloxy)phenyl]-3-methylurea
InChI:
InChI=1S/C15H13N3O2S/c1-16-15(19)18-11-2-4-12(5-3-11)20-13-6-7-14-10(8-13)9-17-21-14/h2-9H,1H3,(H2,16,18,19)
InChI Key:
BNEQZJRSBQYKAF-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1ccc(cc1)Oc1ccc2c(c1)cns2
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.073g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
299.348g/mol
Monoisotopic Mass:
299.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.