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CAS 850140-72-6 Afatinib molecular structure lightbox
CAS RN: 850140-72-6

Afatinib

Product Availability

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8 package records8 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260630 100mg In stock Shanghai Inquiry
Batchno.20250804 10mg In stock Shanghai Inquiry
Batchno.20251201 1g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20251211 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20250801 1mg In stock Shanghai Inquiry
Batchno.20260123 250mg In stock Shanghai Inquiry
Batchno.20250918 25g In stock Shanghai Inquiry
Batchno.20251025 5g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: SSC-192879
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 5g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 850140-72-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥98% 5 In Stock Shenzhen Inquiry
1g ≥98% 2 In Stock Hong Kong Inquiry
5g ≥98% 2 In Stock Shenzhen Inquiry

850140-72-6 / (E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3R)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

Standard CAS: 850140-72-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
850140-72-6
Multi CAS
Yes
Molecular Formula
C24H25CLFN5O3
Molecular Weight
485.900000
Exact Mass
485.162996
InChI
InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m1/s1
InChIKey
ULXXDDBFHOBEHA-QDLOVBKTSA-N

Computed Properties

Structural Parameters

Heavy atom count
34
Aromatic heavy atom count
16
Fraction Csp3
0.29
Rotatable bonds
8
H-bond acceptors
7
H-bond donors
2
Molar refractivity
130.41
TPSA
88.61

LogP / Solubility

WLOGP
4.39
MLOGP
3.9
XLogP3
3.6
Consensus LogP
3.96
Log S (ESOL)
-5.44
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.42
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)
-2.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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