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CAS 68774-78-7 8-CHLORO-3-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE molecular structure lightbox
CAS RN: 68774-78-7

8-CHLORO-3-METHYL-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250418 10g In stock Shanghai Inquiry
Batchno.20260118 1g In stock Shanghai Inquiry
Batchno.20250201 1g / 5g / 10g Confirm by inquiry Shanghai Inquiry
Batchno.20251214 250mg In stock Shanghai Inquiry
Batchno.20250404 5g In stock Shanghai Inquiry
  • Product code: SSC-178458
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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: 5g
  • Available purity: ＞97%
  • 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 68774-78-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

68774-78-7 / 8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine

Standard CAS: 68774-78-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
68774-78-7
Multi CAS
No
Molecular Formula
C6H5CLN4
Molecular Weight
168.580000
Exact Mass
168.020274
InChI
InChI=1S/C6H5ClN4/c1-4-9-10-6-5(7)8-2-3-11(4)6/h2-3H,1H3
InChIKey
RIWAMVRPNJEQJK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.17
H-bond acceptors
4
Molar refractivity
40.53
TPSA
43.08

LogP / Solubility

WLOGP
1.09
MLOGP
0.95
XLogP3
1.5
Consensus LogP
1.18
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.73
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.66
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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