2-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid

2-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid

CAS: 65884-40-4

Formula: C11H13NO3S

SMILES: COC1=CC=C(C=C1)C1NC(CS1)C(O)=O

IUPAC: 2-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid

InChI: InChI=1/C11H13NO3S/c1-15-8-4-2-7(3-5-8)10-12-9(6-16-10)11(13)14/h2-5,9-10,12H,6H2,1H3,(H,13,14)

Composition: C (55.21%), H (5.48%), N (5.85%), O (20.06%), S (13.40%)

Molar Mass: 239.29

Atom Count: 29

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	239.061614457
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	ZQRSXNJVEHLFCE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.73
Topological Polar Surface Area	58.56
Polarizability	24.6
Ring Count	2
Rotatable Bond Count	3

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