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CAS 1536200-31-3 GNE-9605 molecular structure lightbox
CAS RN: 1536200-31-3

GNE-9605

Product Availability

Choose a grade to view its available package options.

14 package records9 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260525 25mg / 100mg Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251206 100mg In stock Shanghai Inquiry
Batchno.20250701 10mg In stock Shanghai Inquiry
Batchno.20251224 1g Out of stock Inquiry
Batchno.20260529 1mg In stock Shanghai Inquiry
Batchno.20250811 250mg Out of stock Inquiry
Batchno.20250823 2mg In stock Shanghai Inquiry
Batchno.20260323 50mg In stock Shanghai Inquiry
Batchno.20251003 5mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250617 100mg In stock Inquiry
Batchno.20250205 25mg Out of stock Inquiry
Batchno.20251210 50mg In stock Inquiry
Batchno.20251115 5mg Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260113 1ml In stock Inquiry
  • Product code: SSC-063021
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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 1536200-31-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry

1536200-31-3 / 2-N-[5-chloro-1-[(3S,4S)-3-fluoro-1-(oxetan-3-yl)piperidin-4-yl]pyrazol-4-yl]-4-N-methyl-5-(trifluoromethyl)pyrimidine-2,4-diamine

Standard CAS: 1536200-31-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1536200-31-3
Multi CAS
No
Molecular Formula
C17H20ClF4N7O
Molecular Weight
449.800000
Exact Mass
449.135399
SMILES
CNC1=NC(=NC=C1C(F)(F)F)NC2=C(N(N=C2)[C@H]3CCN(C[C@@H]3F)C4COC4)Cl
InChI
InChI=1S/C17H20ClF4N7O/c1-23-15-10(17(20,21)22)4-24-16(27-15)26-12-5-25-29(14(12)18)13-2-3-28(6-11(13)19)9-7-30-8-9/h4-5,9,11,13H,2-3,6-8H2,1H3,(H2,23,24,26,27)/t11-,13-/m0/s1
InChIKey
PUXPEQJKNAWNQA-AAEUAGOBSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
11
Fraction Csp3
0.59
Rotatable bonds
5
H-bond acceptors
8
H-bond donors
2
Molar refractivity
101.83
TPSA
80.13

LogP / Solubility

WLOGP
3.11
MLOGP
2.77
XLogP3
2.8
Consensus LogP
2.89
Log S (ESOL)
-4.53
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.77
Class (SILICOS-IT)
Slightly soluble

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)
-3.25

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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