Home Carbonyls 3-(2-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}ethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

3-(2-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}ethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione

CAS No.:
74050-98-9
Catalog Number:
AG0059SA
Molecular Formula:
C22H22FN3O3
Molecular Weight:
395.4268
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
>98%(HPLC)powder
In Stock USA
United States
$60
- +
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG0059SA
Chemical Name:
3-(2-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}ethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione
CAS Number:
74050-98-9
Molecular Formula:
C22H22FN3O3
Molecular Weight:
395.4268
MDL Number:
MFCD00083392
IUPAC Name:
3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
InChI:
InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)
InChI Key:
FPCCSQOGAWCVBH-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)C1CCN(CC1)CCn1c(=O)[nH]c2c(c1=O)cccc2
UNII:
97F9DE4CT4
NSC Number:
758959
Properties
Complexity:
627  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.165g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.434g/mol
Monoisotopic Mass:
395.165g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties