200,000+ products from a single source!
sales@angenechem.com
23456-71-5 | 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-(dimethylamino)-2-methyl-
CAS No: 23456-71-5 Catalog No: AG002NBD MDL No:
Product Description
Catalog Number:
AG002NBD
Chemical Name:
1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-(dimethylamino)-2-methyl-
CAS Number:
23456-71-5
Molecular Formula:
C20H19ClN2O3
Molecular Weight:
370.8295
IUPAC Name:
2-[1-(4-chlorobenzoyl)-5-(dimethylamino)-2-methylindol-3-yl]acetic acid
InChI:
InChI=1S/C20H19ClN2O3/c1-12-16(11-19(24)25)17-10-15(22(2)3)8-9-18(17)23(12)20(26)13-4-6-14(21)7-5-13/h4-10H,11H2,1-3H3,(H,24,25)
InChI Key:
SUSOIBZGVNNEFL-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(C)n(c2c1cc(cc2)N(C)C)C(=O)c1ccc(cc1)Cl
UNII:
TFB9XX4ENR
Properties
Complexity:
533
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.108g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.833g/mol
Monoisotopic Mass:
370.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.