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CAS 51449-86-6 5-(2-Methylphenyl)-1H-tetrazole molecular structure lightbox
CAS RN: 51449-86-6

5-(2-Methylphenyl)-1H-tetrazole

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260106 1g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260313 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20251018 250mg In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250802 5g In stock Shenzhen Inquiry
  • Product code: SSC-158289
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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 51449-86-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shenzhen Inquiry

51449-86-6 / 5-(2-methylphenyl)-2H-tetrazole

Standard CAS: 51449-86-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
51449-86-6
Multi CAS
Yes
Molecular Formula
C8H8N4
Molecular Weight
160.180000
Exact Mass
160.074896
InChI
InChI=1S/C8H8N4/c1-6-4-2-3-5-7(6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)
InChIKey
MTBUOESFHRORQT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
11
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
44.35
TPSA
54.46

LogP / Solubility

WLOGP
1.18
MLOGP
1.03
XLogP3
1.5
Consensus LogP
1.24
Log S (ESOL)
-2.19
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.72
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.8
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)
-2.86

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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