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SR-302

CAT: 0931-T204513-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T204513-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2771319-74-3
Target
Discoidin Domain Receptor (DDR), p38 MAPK
Related Pathways
MAPK, Tyrosine Kinase/Adaptors
Bioactivity
SR-302 is a potent and selective inhibitor of DDR/p38, with IC50 values of 0.125 μM for p38α, 0.023 μM for DDR1, and 0.018 μM for DDR2. It is utilized in research related to fibrotic diseases, such as kidney and lung fibrosis, atherosclerosis, and various types of cancer.
Smiles
C(NCC1=CC=C(C(N[C@H](C(NC2CN(S(C)(=O)=O)CCC2)=O)CCC3CCCCC3)=O)C=C1)(=O)C=4N5C(=NC4)C=CC=C5
Molecular Formula
C32H42N6O5S
Molecular Weight
622.778
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-[[4-[[(2S)-4-cyclohexyl-1-[(1-methylsulfonylpiperidin-3-yl)amino]-1-oxobutan-2-yl]carbamoyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CAS Number2771319-74-3
PubChem CID155568238
IUPAC NameN-[[4-[[(2S)-4-cyclohexyl-1-[(1-methylsulfonylpiperidin-3-yl)amino]-1-oxobutan-2-yl]carbamoyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
Molecular FormulaC32H42N6O5S
Molecular Weight622.8
XLogP4.8
Topological Polar Surface Area150
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Heavy Atom Count44
Formal Charge0
Complexity1090
SMILES
CS(=O)(=O)N1CCCC(C1)NC(=O)[C@H](CCC2CCCCC2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CN=C5N4C=CC=C5
InChI
InChI=1S/C32H42N6O5S/c1-44(42,43)37-18-7-10-26(22-37)35-31(40)27(17-14-23-8-3-2-4-9-23)36-30(39)25-15-12-24(13-16-25)20-34-32(41)28-21-33-29-11-5-6-19-38(28)29/h5-6,11-13,15-16,19,21,23,26-27H,2-4,7-10,14,17-18,20,22H2,1H3,(H,34,41)(H,35,40)(H,36,39)/t26?,27-/m0/s1
InChIKey
WGMNFJAFXXXRLZ-GEVKEYJPSA-N
Chemical Structure
2D Structure
2D structure of N-[[4-[[(2S)-4-cyclohexyl-1-[(1-methylsulfonylpiperidin-3-yl)amino]-1-oxobutan-2-yl]carbamoyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CAS: 2771319-74-3
CID: 155568238
Formula: C32H42N6O5S
MW: 622.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight622.8
XLogP34.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Exact Mass622.29373964
Monoisotopic Mass622.29373964
Topological Polar Surface Area150 Ų
Heavy Atom Count44
Formal Charge0
Complexity1090
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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