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CAS 3641-13-2 3-Amino-1,2,4-triazole-5-carboxylic Acid Hemihydrate molecular structure lightbox
CAS RN: 3641-13-2

3-Amino-1,2,4-triazole-5-carboxylic Acid Hemihydrate

Product Availability

Choose a grade to view its available package options.

9 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251024 100g In stock Shanghai, Chengdu Inquiry
Batchno.20260109 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250406 1g / 5g / 25g / 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong, Chongqing, Hebei Inquiry
Batchno.20250311 1kg In stock Shanghai Inquiry
Batchno.20250624 25g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20260701 500g In stock Shanghai Inquiry
Batchno.20250728 5g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250210 1g In stock Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250302 1g / 5g / 25g Confirm by inquiry Shandong Inquiry
  • Product code: SSC-143604
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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: 1000g
  • 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 3641-13-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1000g ≥95% 0 Out of Stock Shenzhen Inquiry

3641-13-2 / 3-amino-1H-1,2,4-triazole-5-carboxylic acid

Standard CAS: 3641-13-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3641-13-2
Multi CAS
Yes
Molecular Formula
C3H4N4O2
Molecular Weight
128.090000
Exact Mass
128.033425
InChI
InChI=1S/C3H4N4O2/c4-3-5-1(2(8)9)6-7-3/h(H,8,9)(H3,4,5,6,7)
InChIKey
MVRGLMCHDCMPKD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
3
Molar refractivity
27.75
TPSA
104.89

LogP / Solubility

WLOGP
-0.91
MLOGP
-0.81
XLogP3
-0.5
Consensus LogP
-0.74
Log S (ESOL)
-0.4
Class (ESOL)
Very soluble
Log S (Ali)
0.05
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.15
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.15

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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