4-{2-[(1R)-1-[N-(2,5-difluorophenyl)-4-chlorobenzenesulfonamido]ethyl]-5-fluorophenyl}butanoic acid

4-{2-[(1R)-1-[N-(2,5-difluorophenyl)-4-chlorobenzenesulfonamido]ethyl]-5-fluorophenyl}butanoic acid

CAS: 290315-45-6

Formula: C24H21ClF3NO4S

SMILES: C[C@@H](N(C1=CC(F)=CC=C1F)S(=O)(=O)C1=CC=C(Cl)C=C1)C1=CC=C(F)C=C1CCCC(O)=O

IUPAC: 4-{2-[(1R)-1-[N-(2,5-difluorophenyl)-4-chlorobenzenesulfonamido]ethyl]-5-fluorophenyl}butanoic acid

InChI: InChI=1S/C24H21ClF3NO4S/c1-15(21-11-7-18(26)13-16(21)3-2-4-24(30)31)29(23-14-19(27)8-12-22(23)28)34(32,33)20-9-5-17(25)6-10-20/h5-15H,2-4H2,1H3,(H,30,31)/t15-/m1/s1

Composition: C (56.31%), H (4.13%), Cl (6.92%), F (11.13%), N (2.74%), O (12.50%), S (6.26%)

Molar Mass: 511.94

Atom Count: 55

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	511.0831915
Formal Charge	0
FSP3	0.21
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	IZAOBRWCUGOKNH-OAHLLOKOSA-N
Lipinski's Rule of Five
Molar Refractivity	122.78
Topological Polar Surface Area	74.68
Polarizability	47.4
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<7 Days	290315-45-6		$193.55-$1,223.37$193.55$280.49$437.81$664.47$1,223.37

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	290315-45-6		$32.20-$316.25$32.20$126.50$189.75$316.25

Molnova Chemicals

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	290315-45-6		$40.51-$405.90$40.51$71.09$126.89$220.15$405.90