200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 87415-49-4
87415-49-4 | DIMETHYL(2-HYDROXY-3-(NAPHTHALEN-1-YLOXY)PROPYL)(((2,6-XYLYL)CARBAMOYL)METHYL)AMMONIUM CHLORIDE
CAS No: 87415-49-4 Catalog No: AG004GEE MDL No:
Product Description
Catalog Number:
AG004GEE
Chemical Name:
DIMETHYL(2-HYDROXY-3-(NAPHTHALEN-1-YLOXY)PROPYL)(((2,6-XYLYL)CARBAMOYL)METHYL)AMMONIUM CHLORIDE
CAS Number:
87415-49-4
Molecular Formula:
C25H31ClN2O3
Molecular Weight:
442.9782
IUPAC Name:
[2-(2,6-dimethylanilino)-2-oxoethyl]-(2-hydroxy-3-naphthalen-1-yloxypropyl)-dimethylazanium;chloride
InChI:
InChI=1S/C25H30N2O3.ClH/c1-18-9-7-10-19(2)25(18)26-24(29)16-27(3,4)15-21(28)17-30-23-14-8-12-20-11-5-6-13-22(20)23;/h5-14,21,28H,15-17H2,1-4H3;1H
InChI Key:
VHHFHLOCPORFDL-UHFFFAOYSA-N
SMILES:
OC(C[N+](CC(=O)Nc1c(C)cccc1C)(C)C)COc1cccc2c1cccc2.[Cl-]
Properties
Complexity:
543
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
442.202g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
442.984g/mol
Monoisotopic Mass:
442.202g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
Related Products
© 2019 Angene International Limited. All rights Reserved.