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28565-98-2 | Benzoic acid, 2-[(2-phenylacetyl)amino]-
CAS No: 28565-98-2 Catalog No: AG002VPE MDL No:MFCD00437388
Product Description
Catalog Number:
AG002VPE
Chemical Name:
Benzoic acid, 2-[(2-phenylacetyl)amino]-
CAS Number:
28565-98-2
Molecular Formula:
C15H13NO3
Molecular Weight:
255.2686
MDL Number:
MFCD00437388
IUPAC Name:
2-[(2-phenylacetyl)amino]benzoic acid
InChI:
InChI=1S/C15H13NO3/c17-14(10-11-6-2-1-3-7-11)16-13-9-5-4-8-12(13)15(18)19/h1-9H,10H2,(H,16,17)(H,18,19)
InChI Key:
WLWHMIHDEXBKCR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1C(=O)O)Cc1ccccc1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.273g/mol
Monoisotopic Mass:
255.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Nonpeptide inhibitors of measles virus entry. | Journal of medicinal chemistry 20060824 |
| 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 |
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