CAS 150256-42-1 | Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]- | CAS Number 150256-42-1

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150256-42-1 | Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-

CAS No: 150256-42-1 Catalog No: AG001MG0 MDL No:MFCD00235883

Product Description

Catalog Number:

AG001MG0

Chemical Name:

Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-

CAS Number:

150256-42-1

Molecular Formula:

C22H17NO4

Molecular Weight:

359.3747

MDL Number:

MFCD00235883

IUPAC Name:

2-(9H-fluoren-9-ylmethoxycarbonylamino)benzoic acid

InChI:

InChI=1S/C22H17NO4/c24-21(25)18-11-5-6-12-20(18)23-22(26)27-13-19-16-9-3-1-7-14(16)15-8-2-4-10-17(15)19/h1-12,19H,13H2,(H,23,26)(H,24,25)

InChI Key:

CNAVPEPPAVHHKN-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccccc1C(=O)O)OCC1c2ccccc2c2c1cccc2

Properties

Complexity:

528

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

359.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

359.381g/mol

Monoisotopic Mass:

359.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Identification of non-nucleoside DNA synthesis inhibitors of vaccinia virus by high-throughput screening.	Journal of medicinal chemistry 20081023
Inhibition of the Na+/dicarboxylate cotransporter by anthranilic acid derivatives.	Molecular pharmacology 20071101