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BAY-207

CAT: 0926-HWD17757-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-HWD17757-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2407177-57-3
Smiles
NS (=O) (=O) C1C=C (C=CC=1OC1=CC (Cl) =CC=C1) NC (=O) C1 (CC1) C1=CC=CC=C1Cl
Molecular Formula
C22H18Cl2N2O4S
Molecular Weight
477.36 g/mol
Controlled
No

Chemical Information

N-[4-(3-chlorophenoxy)-3-sulfamoylphenyl]-1-(2-chlorophenyl)cyclopropane-1-carboxamide
CAS Number2407177-57-3
PubChem CID155540682
IUPAC NameN-[4-(3-chlorophenoxy)-3-sulfamoylphenyl]-1-(2-chlorophenyl)cyclopropane-1-carboxamide
Molecular FormulaC22H18Cl2N2O4S
Molecular Weight477.4
XLogP4.4
Topological Polar Surface Area107
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity755
SMILES
C1CC1(C2=CC=CC=C2Cl)C(=O)NC3=CC(=C(C=C3)OC4=CC(=CC=C4)Cl)S(=O)(=O)N
InChI
InChI=1S/C22H18Cl2N2O4S/c23-14-4-3-5-16(12-14)30-19-9-8-15(13-20(19)31(25,28)29)26-21(27)22(10-11-22)17-6-1-2-7-18(17)24/h1-9,12-13H,10-11H2,(H,26,27)(H2,25,28,29)
InChIKey
JXAOITUGCKTSTF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[4-(3-chlorophenoxy)-3-sulfamoylphenyl]-1-(2-chlorophenyl)cyclopropane-1-carboxamide
CAS: 2407177-57-3
CID: 155540682
Formula: C22H18Cl2N2O4S
MW: 477.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.4
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass476.0364336
Monoisotopic Mass476.0364336
Topological Polar Surface Area107 Ų
Heavy Atom Count31
Formal Charge0
Complexity755
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

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