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CAS 14070-48-5 1-(3-Acetamidophenyl)-5-mercaptotetrazole molecular structure lightbox
CAS RN: 14070-48-5

1-(3-Acetamidophenyl)-5-mercaptotetrazole

Product Availability

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4 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityInquiry
Batchno.20260226 1g In stock Inquiry
Batchno.20260416 25g Out of stock Inquiry
Batchno.20250927 5g In stock Inquiry
Batch No.PackageAvailabilityInquiry
Batchno.20260121 5g Out of stock Inquiry
  • Product code: SSC-051231
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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: 10g
  • 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 14070-48-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥95% 0 Out of Stock Beijing Inquiry

14070-48-5 / N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]acetamide

Standard CAS: 14070-48-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
14070-48-5
Multi CAS
No
Molecular Formula
C9H9N5OS
Molecular Weight
235.270000
Exact Mass
235.052781
SMILES
CC(=O)NC1=CC(=CC=C1)N2C(=S)N=NN2
InChI
InChI=1S/C9H9N5OS/c1-6(15)10-7-3-2-4-8(5-7)14-9(16)11-12-13-14/h2-5H,1H3,(H,10,15)(H,11,13,16)
InChIKey
SCWKACOBHZIKDI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
11
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
60.85
TPSA
75.6

LogP / Solubility

WLOGP
1.28
MLOGP
1.13
XLogP3
2
Consensus LogP
1.47
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.49
Class (SILICOS-IT)
Moderately 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)
-3.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Flammable
Signal
Danger Warning
GHS Hazard Statements
H228 (66.7%): Flammable solid [Danger Flammable solids] H228 (100%): Flammable solid [Danger Flammable solids]
Precautionary Statement Codes
P210, P240, P241, P280, and P370+P378

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