Home Carbonyls N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1h-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide

N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1h-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide

CAS No.:
137973-76-3
Catalog Number:
AG0017QX
Molecular Formula:
C26H23ClN2O3
Molecular Weight:
446.9254
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
99%(HPLC)
In Stock USA
United States
$88
- +
100mg
99%(HPLC)
In Stock USA
United States
$156
- +
Product Description
Catalog Number:
AG0017QX
Chemical Name:
N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1h-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide
CAS Number:
137973-76-3
Molecular Formula:
C26H23ClN2O3
Molecular Weight:
446.9254
MDL Number:
MFCD19440797
IUPAC Name:
N-[4-(7-chloro-5-oxo-3,4-dihydro-2H-1-benzazepine-1-carbonyl)-3-methylphenyl]-2-methylbenzamide
InChI:
InChI=1S/C26H23ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15H,5,8,13H2,1-2H3,(H,28,31)
InChI Key:
VENGMROMZOKURN-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(=O)CCCN2C(=O)c1ccc(cc1C)NC(=O)c1ccccc1C
Properties
Complexity:
713  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.14g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
446.931g/mol
Monoisotopic Mass:
446.14g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties