200,000+ products from a single source!
sales@angenechem.com
1137621-29-4 | 2-Propenoic acid, 3-[3-[(phenylaMino)sulfonyl]phenyl]-, ethyl ester, (2E)-
CAS No: 1137621-29-4 Catalog No: AG0009KY MDL No:
Product Description
Catalog Number:
AG0009KY
Chemical Name:
2-Propenoic acid, 3-[3-[(phenylaMino)sulfonyl]phenyl]-, ethyl ester, (2E)-
CAS Number:
1137621-29-4
Molecular Formula:
C17H17NO4S
Molecular Weight:
331.3862
IUPAC Name:
ethyl (E)-3-[3-(phenylsulfamoyl)phenyl]prop-2-enoate
InChI:
InChI=1S/C17H17NO4S/c1-2-22-17(19)12-11-14-7-6-10-16(13-14)23(20,21)18-15-8-4-3-5-9-15/h3-13,18H,2H2,1H3/b12-11+
InChI Key:
IBGWMJSZBGFJCA-VAWYXSNFSA-N
SMILES:
CCOC(=O)/C=C/c1cccc(c1)S(=O)(=O)Nc1ccccc1
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
331.088g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.386g/mol
Monoisotopic Mass:
331.088g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.