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MI-773

CAT: 0957-E7511-1mgSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0957-E7511-1mgSize:1 mg
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CAS Number
1303607-07-9
Synonyms
SAR405838, MI-77301
Additionnal Information
MI-773 is a potent MDM2-p53 protein‐protein interaction (PPI) inhibitor with high binding affinity against MDM2 (Kd=8.2 nM) . MI-773 has antitumor activity. MI-773 (CAS: 1303607-07-9) is a diastereomer of SAR405838 (CAS: 1303607-60-4) .

Chemical Information

(2'R,3S,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-1,2-dihydro-N-(trans-4-hydroxycyclohexyl)-2-oxospiro[3H-indole-3,3'-pyrrolidine]-5'-carboxamide
CAS Number1303607-07-9
PubChem CID52938482
IUPAC Name(2'R,3S,3'S,5'R)-6-chloro-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-N-(4-hydroxycyclohexyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
Molecular FormulaC29H34Cl2FN3O3
Molecular Weight562.5
XLogP5.3
Topological Polar Surface Area90.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count38
Formal Charge0
Complexity895
SMILES
CC(C)(C)C[C@@H]1[C@]2([C@H]([C@@H](N1)C(=O)NC3CCC(CC3)O)C4=C(C(=CC=C4)Cl)F)C5=C(C=C(C=C5)Cl)NC2=O
InChI
InChI=1S/C29H34Cl2FN3O3/c1-28(2,3)14-22-29(19-12-7-15(30)13-21(19)34-27(29)38)23(18-5-4-6-20(31)24(18)32)25(35-22)26(37)33-16-8-10-17(36)11-9-16/h4-7,12-13,16-17,22-23,25,35-36H,8-11,14H2,1-3H3,(H,33,37)(H,34,38)/t16?,17?,22-,23+,25-,29+/m1/s1
InChIKey
IDKAKZRYYDCJDU-YJRDPZTCSA-N
Chemical Structure
2D Structure
2D structure of (2'R,3S,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-1,2-dihydro-N-(trans-4-hydroxycyclohexyl)-2-oxospiro[3H-indole-3,3'-pyrrolidine]-5'-carboxamide
CAS: 1303607-07-9
CID: 52938482
Formula: C29H34Cl2FN3O3
MW: 562.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight562.5
XLogP35.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass561.1961255
Monoisotopic Mass561.1961255
Topological Polar Surface Area90.5 Ų
Heavy Atom Count38
Formal Charge0
Complexity895
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T63974-01MI-773
A15440-500MI-773 500mg
A15440-25MI-773 25mg
A14423-50MI-773 50mg
A15440-10MI-773 10mg
A14423-5MI-773 5mg
MBS3840361-01MI-773 (SAR405838)
A15440-100MI-773 100mg
A15440-2MI-773 2mg

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