CAS RN: 1174046-72-0
BMS-794833
Product Availability
Choose a grade to view its available package options.
14 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250729 | 100mg | Out of stock | Inquiry | ||
| Batchno.20260530 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250619 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250401 | 1mg / 5mg / 25mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20260407 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250316 | 25mg | Out of stock | Inquiry | ||
| Batchno.20250319 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250626 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250820 | 1ml | In stock | Inquiry |
- Product code: starshine_CAS1174046-72-0
- Purity/Analytical Methods: >99.0%
1174046-72-0 / N-[4-[(2-amino-3-chloro-4-pyridinyl)oxy]-3-fluorophenyl]-5-(4-fluorophenyl)-4-oxo-1H-pyridine-3-carboxamide
BMS-794833 | BMS 794833 | BMS794833
Basic Information
CAS
1174046-72-0
Multi CAS
Yes
Molecular Formula
C23H15ClF2N4O3
Molecular Weight
468.800000
Exact Mass
468.080074
SMILES
C1=CC(=CC=C1C2=CNC=C(C2=O)C(=O)NC3=CC(=C(C=C3)OC4=C(C(=NC=C4)N)Cl)F)F
InChI
InChI=1S/C23H15ClF2N4O3/c24-20-19(7-8-29-22(20)27)33-18-6-5-14(9-17(18)26)30-23(32)16-11-28-10-15(21(16)31)12-1-3-13(25)4-2-12/h1-11H,(H2,27,29)(H,28,31)(H,30,32)
InChIKey
PDYXPCKITKHFOZ-UHFFFAOYSA-N
Synonyms
BMS-794833
BMS 794833
BMS794833
N-(4-((2-amino-3-chloropyridin-4-yl)oxy)-3-fluorophenyl)-5-(4-fluorophenyl)-4-oxo-1,4-dihydropyridine-3-carboxamide
metatinib
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
24
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
3
Molar refractivity
120.54
TPSA
110.1
LogP / Solubility
WLOGP
5
MLOGP
4.43
XLogP3
3.8
Consensus LogP
4.41
Log S (ESOL)
-6.1
Class (ESOL)
Insoluble
Log S (Ali)
-7.01
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.45
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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