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CAS 1892576-58-7 PF-06747711 molecular structure lightbox
CAS RN: 1892576-58-7

PF-06747711

Product Availability

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8 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250202 100mg Out of stock Inquiry
Batchno.20250211 10mg In stock Shanghai Inquiry
Batchno.20250923 1mg In stock Shanghai Inquiry
Batchno.20250126 250mg Out of stock Inquiry
Batchno.20251225 25mg Out of stock Inquiry
Batchno.20260510 25mg / 50mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
Batchno.20250324 50mg Out of stock Inquiry
Batchno.20250113 5mg In stock Shanghai Inquiry
  • Product code: SSC-088360
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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: 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 1892576-58-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1892576-58-7 / 3-cyano-N-[1-methyl-3-[1-(2-methylpropanoyl)piperidin-4-yl]-4-(trifluoromethyl)pyrrolo[2,3-b]pyridin-5-yl]benzamide

Standard CAS: 1892576-58-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1892576-58-7
Multi CAS
No
Molecular Formula
C26H26F3N5O2
Molecular Weight
497.500000
Exact Mass
497.203860
SMILES
CC(C)C(=O)N1CCC(CC1)C2=CN(C3=NC=C(C(=C23)C(F)(F)F)NC(=O)C4=CC=CC(=C4)C#N)C
InChI
InChI=1S/C26H26F3N5O2/c1-15(2)25(36)34-9-7-17(8-10-34)19-14-33(3)23-21(19)22(26(27,28)29)20(13-31-23)32-24(35)18-6-4-5-16(11-18)12-30/h4-6,11,13-15,17H,7-10H2,1-3H3,(H,32,35)
InChIKey
BIHPJIJLDNUDGH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
36
Aromatic heavy atom count
15
Fraction Csp3
0.38
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
1
Molar refractivity
128.22
TPSA
91.02

LogP / Solubility

WLOGP
5.08
MLOGP
4.5
XLogP3
3.8
Consensus LogP
4.46
Log S (ESOL)
-6.17
Class (ESOL)
Insoluble
Log S (Ali)
-7.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.59
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)
-2.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

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