Products for Research Use Only
RegisterLogin

MS 154N

CAT: 0931-T41157Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T41157Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2675490-97-6
Target
Others, PROTACs, EGFR
Related Pathways
PROTAC, JAK/STAT signaling, Tyrosine Kinase/Adaptors, Others, Angiogenesis
Bioactivity
MS 154N is a negative control for MS 154. The compound exhibits high binding-affinity for WT and L858R-mutant EGFR (Kdvalues are 3 and 4.3 nM, respectively), but does not significantly induce degradation of EGFR mutants.
Smiles
O=C1C=2C(C(=O)N1C3C(=O)N(C)C(=O)CC3)=CC=CC2OCCCCCCCCNC(CCN4CCN(CCCOC5=CC6=C(C=C5OC)N=CN=C6NC7=CC(Cl)=C(F)C=C7)CC4)=O
Molecular Formula
C47H56ClFN8O8
Molecular Weight
915.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Negative control for MS154
CAS Number2675490-97-6
PubChem CID155515813
IUPAC Name3-[4-[3-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypropyl]piperazin-1-yl]-N-[8-[2-(1-methyl-2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyoctyl]propanamide
Molecular FormulaC47H56ClFN8O8
Molecular Weight915.4
XLogP6.1
Topological Polar Surface Area176
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count14
Rotatable Bond Count22
Heavy Atom Count65
Formal Charge0
Complexity1600
SMILES
CN1C(=O)CCC(C1=O)N2C(=O)C3=C(C2=O)C(=CC=C3)OCCCCCCCCNC(=O)CCN4CCN(CC4)CCCOC5=C(C=C6C(=C5)C(=NC=N6)NC7=CC(=C(C=C7)F)Cl)OC
InChI
InChI=1S/C47H56ClFN8O8/c1-54-42(59)16-15-37(46(54)61)57-45(60)32-11-9-12-38(43(32)47(57)62)64-25-8-6-4-3-5-7-18-50-41(58)17-20-56-23-21-55(22-24-56)19-10-26-65-40-28-33-36(29-39(40)63-2)51-30-52-44(33)53-31-13-14-35(49)34(48)27-31/h9,11-14,27-30,37H,3-8,10,15-26H2,1-2H3,(H,50,58)(H,51,52,53)
InChIKey
XFUDPXQGWCYCCR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Negative control for MS154
CAS: 2675490-97-6
CID: 155515813
Formula: C47H56ClFN8O8
MW: 915.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight915.4
XLogP36.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count14
Rotatable Bond Count22
Exact Mass914.3893666
Monoisotopic Mass914.3893666
Topological Polar Surface Area176 Ų
Heavy Atom Count65
Formal Charge0
Complexity1600
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T41155MS 154
T16151-01Ms-PEG7-Ms
T16148-01Ms-PEG2-Ms
T38491-01Ms-PEG6-Ms
T16149-01Ms-PEG4-Ms
T202458-01MS-8709
T41291-01MS-PPOH
T41156MS 39
T202408-01MS-153
T201371MS-L6

Alternative Products

CatalogName
7396/5MS 154N

Popular Products