3,4-bis(2-methylbenzamido)benzoic acid

3,4-bis(2-methylbenzamido)benzoic acid

Formula: C23H20N2O4

SMILES: CC1=CC=CC=C1C(=O)NC1=CC=C(C=C1NC(=O)C1=CC=CC=C1C)C(O)=O

IUPAC: 3,4-bis(2-methylbenzamido)benzoic acid

InChI: InChI=1S/C23H20N2O4/c1-14-7-3-5-9-17(14)21(26)24-19-12-11-16(23(28)29)13-20(19)25-22(27)18-10-6-4-8-15(18)2/h3-13H,1-2H3,(H,24,26)(H,25,27)(H,28,29)

Composition: C (71.12%), H (5.19%), N (7.21%), O (16.48%)

Molar Mass: 388.423

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	388.142307132
Formal Charge	0
FSP3	0.09
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	XBEWACZSSADZMS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	114.46
Topological Polar Surface Area	95.5
Polarizability	41.4
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H20N2O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00