2-[4-(2-methoxybenzamido)benzamido]benzoic acid

2-[4-(2-methoxybenzamido)benzamido]benzoic acid

CAS: 693241-54-2

Formula: C22H18N2O5

SMILES: COC1=CC=CC=C1C(=O)NC1=CC=C(C=C1)C(=O)NC1=CC=CC=C1C(O)=O

IUPAC: 2-[4-(2-methoxybenzamido)benzamido]benzoic acid

InChI: InChI=1S/C22H18N2O5/c1-29-19-9-5-3-7-17(19)21(26)23-15-12-10-14(11-13-15)20(25)24-18-8-4-2-6-16(18)22(27)28/h2-13H,1H3,(H,23,26)(H,24,25)(H,27,28)

Composition: C (67.69%), H (4.65%), N (7.18%), O (20.49%)

Molar Mass: 390.395

Atom Count: 47

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	390.121571688
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	GYZZRJRJYVMXNS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	110.84
Topological Polar Surface Area	104.73
Polarizability	40.4
Ring Count	3
Rotatable Bond Count	6

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