(1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexane-1-carboxylic acid

(1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexane-1-carboxylic acid

Formula: C21H24N2O6S

SMILES: COC1=CC=C(NS(=O)(=O)C2=CC=C(NC(=O)[C@H]3CCCC[C@H]3C(O)=O)C=C2)C=C1

IUPAC: (1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexane-1-carboxylic acid

InChI: InChI=1S/C21H24N2O6S/c1-29-16-10-6-15(7-11-16)23-30(27,28)17-12-8-14(9-13-17)22-20(24)18-4-2-3-5-19(18)21(25)26/h6-13,18-19,23H,2-5H2,1H3,(H,22,24)(H,25,26)/t18-,19+/m0/s1

Composition: C (58.32%), H (5.59%), N (6.48%), O (22.20%), S (7.41%)

Molar Mass: 432.49

Atom Count: 54

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	432.135507675
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	IHZNEGNAWUEPCJ-RBUKOAKNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.66
Topological Polar Surface Area	121.8
Polarizability	43.48
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H24N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00