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294890-34-9 | Benzoic acid, 2-[[4-[(2,2-diphenylacetyl)amino]benzoyl]amino]-
CAS No: 294890-34-9 Catalog No: AG002YK7 MDL No:
Product Description
Catalog Number:
AG002YK7
Chemical Name:
Benzoic acid, 2-[[4-[(2,2-diphenylacetyl)amino]benzoyl]amino]-
CAS Number:
294890-34-9
Molecular Formula:
C28H22N2O4
Molecular Weight:
450.4853
IUPAC Name:
2-[[4-[(2,2-diphenylacetyl)amino]benzoyl]amino]benzoic acid
InChI:
InChI=1S/C28H22N2O4/c31-26(30-24-14-8-7-13-23(24)28(33)34)21-15-17-22(18-16-21)29-27(32)25(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-18,25H,(H,29,32)(H,30,31)(H,33,34)
InChI Key:
SNUJNWNUJQTMPJ-UHFFFAOYSA-N
SMILES:
O=C(C(c1ccccc1)c1ccccc1)Nc1ccc(cc1)C(=O)Nc1ccccc1C(=O)O
Properties
Complexity:
673
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.158g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
450.494g/mol
Monoisotopic Mass:
450.158g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
Literature
| Title | Journal |
|---|---|
| Targeting Tn5 transposase identifies human immunodeficiency virus type 1 inhibitors. | Antimicrobial agents and chemotherapy 20050501 |
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