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CAS 1218779-75-9 Apatinib Mesylate molecular structure lightbox
CAS RN: 1218779-75-9

Apatinib Mesylate

Product Availability

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17 package records16 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251017 100mg In stock Shanghai, Chongqing Inquiry
Batchno.20260616 100mg In stock Inquiry
Batchno.20260110 10mg In stock Inquiry
Batchno.20250902 1mg Out of stock Inquiry
Batchno.20250418 25mg In stock Shanghai, Guangdong Inquiry
Batchno.20251122 25mg In stock Inquiry
Batchno.20251117 50mg In stock Inquiry
Batchno.20250603 5mg In stock Shanghai, Shandong Inquiry
Batchno.20260627 5mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260518 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260108 100mg In stock Shanghai Inquiry
Batchno.20251114 10mg In stock Shanghai, Wuhan Inquiry
Batchno.20260624 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20260408 250mg In stock Shanghai Inquiry
Batchno.20260106 2mg In stock Shanghai, Wuhan Inquiry
Batchno.20260515 50mg In stock Shanghai Inquiry
Batchno.20250613 5mg In stock Shanghai Inquiry
  • Product code: SSC-024638
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1218779-75-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry

1218779-75-9 / N-[4-(1-cyanocyclopentyl)phenyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide;methanesulfonic acid

Standard CAS: 1218779-75-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1218779-75-9
Multi CAS
No
Molecular Formula
C25H27N5O4S
Molecular Weight
493.600000
Exact Mass
493.178376
SMILES
CS(=O)(=O)O.C1CCC(C1)(C#N)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4
InChI
InChI=1S/C24H23N5O.CH4O3S/c25-17-24(11-1-2-12-24)19-5-7-20(8-6-19)29-23(30)21-4-3-13-27-22(21)28-16-18-9-14-26-15-10-18;1-5(2,3)4/h3-10,13-15H,1-2,11-12,16H2,(H,27,28)(H,29,30);1H3,(H,2,3,4)
InChIKey
FYJROXRIVQPKRY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
35
Aromatic heavy atom count
18
Fraction Csp3
0.28
Rotatable bonds
6
H-bond acceptors
7
H-bond donors
3
Molar refractivity
133.43
TPSA
145.07

LogP / Solubility

WLOGP
4.18
MLOGP
3.71
XLogP3
4.18
Consensus LogP
4.02
Log S (ESOL)
-5.52
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.63
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.06
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
-2.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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