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Home Other Building Blocks P-(BENZYLSULFONAMIDO)BENZOIC ACID

P-(BENZYLSULFONAMIDO)BENZOIC ACID

CAS No.:
536-95-8
Catalog Number:
AG00E0CC
Molecular Formula:
C14H13NO4S
Molecular Weight:
291.3223
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$202
- +
5g
1 week
United States
$773
- +
10g
1 week
United States
$1360
- +
Product Description
Catalog Number:
AG00E0CC
Chemical Name:
P-(BENZYLSULFONAMIDO)BENZOIC ACID
CAS Number:
536-95-8
Molecular Formula:
C14H13NO4S
Molecular Weight:
291.3223
MDL Number:
MFCD00020312
IUPAC Name:
4-(benzylsulfonylamino)benzoic acid
InChI:
InChI=1S/C14H13NO4S/c16-14(17)12-6-8-13(9-7-12)15-20(18,19)10-11-4-2-1-3-5-11/h1-9,15H,10H2,(H,16,17)
InChI Key:
ZOFLWJXPXAHZLI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)NS(=O)(=O)Cc1ccccc1
UNII:
6ZV1PP6LGM
NSC Number:
18778
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.057g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
291.321g/mol
Monoisotopic Mass:
291.057g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Design and synthesis of small molecule glycerol 3-phosphate acyltransferase inhibitors. Journal of medicinal chemistry 20090528
Properties