CAS RN: 284461-73-0

Sorafenib

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251103 50mg / 100mg / 1g / 5g / 25g / 100g Confirm by inquiry Shandong, Shanghai, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250312 100g In stock Shanghai Inquiry
Batchno.20250131 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260603 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20260130 500g Out of stock Inquiry
Batchno.20260326 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: ICTO0599
  • Purity/Analytical Methods: >98.0%(T)(HPLC)
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284461-73-0 / 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide

Standard CAS: 284461-73-0 Multi CAS: Yes

Basic Information

CAS
284461-73-0
Multi CAS
Yes
Molecular Formula
C21H16CLF3N4O3
Molecular Weight
464.800000
Exact Mass
464.086303
InChI
InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)
InChIKey
MLDQJTXFUGDVEO-UHFFFAOYSA-N

Physical Properties

Melting Point
187-226 205.6 °C
Physical Description
Solid
Appearance
White solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
113.24
TPSA
92.35

LogP / Solubility

WLOGP
5.55
MLOGP
4.92
XLogP3
4.1
Consensus LogP
4.86
Log S (ESOL)
-6.3
Class (ESOL)
Insoluble
Log S (Ali)
-7.38
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.89
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.62

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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