Products for Research Use Only
RegisterLogin

Zafirlukast Related Compound E

CAT: 1596-AR-Z01005-01Size: 10 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-Z01005-01Size:10 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1159195-70-6
Synonyms
Cyclopentyl (3- (2-methoxy-4- (tosylcarbamoyl) benzyl) -1-methyl-1H-indol-5-yl) carbamate; Zafirlukast P-Tolyl Isomer; [3-[4- (4-Methylphenylsulfonylcarbamoyl) -2-methoxybenzyl]-1-methyl-1H-indole-5-yl]carbamic acid cyclopentyl ester; Cyclopentyl [3- ({2-methoxy-4-[ (4-methylbenzene-1-sulfonyl) carbamoyl]phenyl}methyl) -1-methyl-1H-indol-5-yl]carbamate
Molecular Formula
C31H33N3O6S
Molecular Weight
575.69
API Name
Zafirlukast

Chemical Information

Zafirlukast p-Tolyl Isomer
CAS Number1159195-70-6
PubChem CID42633113
IUPAC Namecyclopentyl N-[3-[[2-methoxy-4-[(4-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindol-5-yl]carbamate
Molecular FormulaC31H33N3O6S
Molecular Weight575.7
XLogP5.5
Topological Polar Surface Area124
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count41
Formal Charge0
Complexity1000
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)NC(=O)OC5CCCC5)C)OC
InChI
InChI=1S/C31H33N3O6S/c1-20-8-13-26(14-9-20)41(37,38)33-30(35)22-11-10-21(29(17-22)39-3)16-23-19-34(2)28-15-12-24(18-27(23)28)32-31(36)40-25-6-4-5-7-25/h8-15,17-19,25H,4-7,16H2,1-3H3,(H,32,36)(H,33,35)
InChIKey
HOOQJZTUMKGZMP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Zafirlukast p-Tolyl Isomer
CAS: 1159195-70-6
CID: 42633113
Formula: C31H33N3O6S
MW: 575.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight575.7
XLogP35.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass575.20900695
Monoisotopic Mass575.20900695
Topological Polar Surface Area124 Ų
Heavy Atom Count41
Formal Charge0
Complexity1000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-Z01003-01Zafirlukast Related Compound C
AR-Z01004-01Zafirlukast Related Compound D
AR-B01765-01Bisoprolol Related Compound E
AR-I01415-01Imiquimod Related Compound E
AR-C05359-01Carvedilol Related Compound E
AR-B01103-01Benazepril Related Compound E
AR-V16880-01Valsartan Related Compound E
AR-E01632-01Eprosartan related compound E
AR-B06184-01Benazepril Related Compound E
AR-T02584-01Amoxicillin Related Compound E

Alternative Products

CatalogName
CS-T-14678Zafirlukast Related Compound C
CS-T-46710Zafirlukast Related Compound D
CS-T-46712Zafirlukast Related Compound E
CS-EG-03533Tramadol Related Compound A
LBA32143-01Naphazoline Related Compound A
KCA72991-01Trimethoprim Related Compound A
IH181667-01Hyoscyamine related compound A
FCA19889-01Clonazepam related compound A
GAA53882-01Levocarnitine Related Compound A
GAA34172-01Flurbiprofen Related Compound A

Popular Products