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Home Other Building Blocks 1-Benzyl-1H-benzo[d][1,3]oxazine-2,4-dione

1-Benzyl-1H-benzo[d][1,3]oxazine-2,4-dione

CAS No.:
35710-05-5
Catalog Number:
AG00C0JF
Molecular Formula:
C15H11NO3
Molecular Weight:
253.2527
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$128
- +
1g
97%
In Stock USA
United States
$168
- +
5g
97%
In Stock USA
United States
$323
- +
Product Description
Catalog Number:
AG00C0JF
Chemical Name:
1-Benzyl-1H-benzo[d][1,3]oxazine-2,4-dione
CAS Number:
35710-05-5
Molecular Formula:
C15H11NO3
Molecular Weight:
253.2527
MDL Number:
MFCD00070638
IUPAC Name:
1-benzyl-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C15H11NO3/c17-14-12-8-4-5-9-13(12)16(15(18)19-14)10-11-6-2-1-3-7-11/h1-9H,10H2
InChI Key:
XZNZVRHSHRYPDL-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)c2c(n1Cc1ccccc1)cccc2
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.074g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.257g/mol
Monoisotopic Mass:
253.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Identification and development of the 1,4-benzodiazepin-2-one and quinazoline-2,4-dione scaffolds as submicromolar inhibitors of HAT. Bioorganic & medicinal chemistry 20121015
Properties