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CAS 264233-05-8 CID 2745687 molecular structure lightbox
CAS RN: 264233-05-8

CID 2745687

Product Availability

Choose a grade to view its available package options.

8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250519 1mg Out of stock Inquiry
Batchno.20260314 25mg In stock Inquiry
Batchno.20250513 5mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260501 100mg In stock Shanghai Inquiry
Batchno.20251024 10mg In stock Shanghai Inquiry
Batchno.20251229 250mg In stock Shanghai Inquiry
Batchno.20250629 25mg In stock Shanghai Inquiry
Batchno.20250406 50mg In stock Shanghai Inquiry
  • Product code: SSC-124113
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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 264233-05-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry

264233-05-8 / methyl 5-[(tert-butylcarbamothioylhydrazinylidene)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate

Standard CAS: 264233-05-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
264233-05-8
Multi CAS
No
Molecular Formula
C17H19F2N5O2S
Molecular Weight
395.400000
Exact Mass
395.122752
SMILES
CC(C)(C)NC(=S)NN=CC1=C(C=NN1C2=C(C=C(C=C2)F)F)C(=O)OC
InChI
InChI=1S/C17H19F2N5O2S/c1-17(2,3)22-16(27)23-20-9-14-11(15(25)26-4)8-21-24(14)13-6-5-10(18)7-12(13)19/h5-9H,1-4H3,(H2,22,23,27)
InChIKey
CYNLZIBKERMMOA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
11
Fraction Csp3
0.29
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
2
Molar refractivity
101.04
TPSA
80.54

LogP / Solubility

WLOGP
2.53
MLOGP
2.25
XLogP3
2.9
Consensus LogP
2.56
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.63
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.81
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)
-3.33

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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