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TOP1362

CAT: 0013-GTR19209637-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209637-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TOP1362 is a narrow-spectrum kinase inhibitor targeting p38α, Syk, Src, and Lck. It demonstrates potent anti-inflammatory effects in cellular models and in vivo endotoxin-induced uveitis (EIU), reducing cytokine release and inflammatory cell infiltration with efficacy comparable to dexamethasone, supporting research for ocular inflammatory disorders.
CAS Number
1630203-25-6
Smiles
O (C=1C2=C (C (NC (NC3=C (OC) C (NS (C) (=O) =O) =CC (C (C) (C) C) =C3) =O) =CC1) C=CC=C2) C=4C=C (NC5=CC (C (NCCCN6CCOCC6) =O) =CC (OC) =C5) N=CC4
Molecular Formula
C43H51N7O8S
Molecular Weight
825.97
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-((4-((4-(3-(5-(tert-Butyl)-2-methoxy-3-(methylsulfonamido)phenyl)ureido)naphthalen-1-yl)oxy)pyridin-2-yl)amino)-5-methoxy-N-(3-morpholinopropyl)benzamide
CAS Number1630203-25-6
PubChem CID86275224
IUPAC Name3-[[4-[4-[[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]carbamoylamino]naphthalen-1-yl]oxy-2-pyridinyl]amino]-5-methoxy-N-(3-morpholin-4-ylpropyl)benzamide
Molecular FormulaC43H51N7O8S
Molecular Weight826.0
XLogP5.9
Topological Polar Surface Area190
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count16
Heavy Atom Count59
Formal Charge0
Complexity1440
SMILES
CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OC4=CC(=NC=C4)NC5=CC(=CC(=C5)C(=O)NCCCN6CCOCC6)OC
InChI
InChI=1S/C43H51N7O8S/c1-43(2,3)29-24-36(40(56-5)37(25-29)49-59(6,53)54)48-42(52)47-35-12-13-38(34-11-8-7-10-33(34)35)58-31-14-16-44-39(27-31)46-30-22-28(23-32(26-30)55-4)41(51)45-15-9-17-50-18-20-57-21-19-50/h7-8,10-14,16,22-27,49H,9,15,17-21H2,1-6H3,(H,44,46)(H,45,51)(H2,47,48,52)
InChIKey
NIMKGKUGIJVPTM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-((4-((4-(3-(5-(tert-Butyl)-2-methoxy-3-(methylsulfonamido)phenyl)ureido)naphthalen-1-yl)oxy)pyridin-2-yl)amino)-5-methoxy-N-(3-morpholinopropyl)benzamide
CAS: 1630203-25-6
CID: 86275224
Formula: C43H51N7O8S
MW: 826.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight826.0
XLogP35.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count12
Rotatable Bond Count16
Exact Mass825.35198278
Monoisotopic Mass825.35198278
Topological Polar Surface Area190 Ų
Heavy Atom Count59
Formal Charge0
Complexity1440
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

Alternative Products

CatalogName
T70346-01TOP1362

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