200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1372762-53-2
1372762-53-2 | (2E)-3-[1-(benzenesulfonyl)-1H-indol-5-yl]prop-2-enoic acid
CAS No: 1372762-53-2 Catalog No: AG00IU44 MDL No:MFCD22375449
Product Description
Catalog Number:
AG00IU44
Chemical Name:
(2E)-3-[1-(benzenesulfonyl)-1H-indol-5-yl]prop-2-enoic acid
CAS Number:
1372762-53-2
Molecular Formula:
C17H13NO4S
Molecular Weight:
327.3544
MDL Number:
MFCD22375449
IUPAC Name:
3-[1-(benzenesulfonyl)indol-5-yl]prop-2-enoic acid
InChI:
InChI=1S/C17H13NO4S/c19-17(20)9-7-13-6-8-16-14(12-13)10-11-18(16)23(21,22)15-4-2-1-3-5-15/h1-12H,(H,19,20)
InChI Key:
TUAZQHVEGHPVSA-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C/c1ccc2c(c1)ccn2S(=O)(=O)c1ccccc1
Properties
Complexity:
560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.057g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.354g/mol
Monoisotopic Mass:
327.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.