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CAS 27943-07-3 5-CYCLOPROPYL-2H-1,2,3,4-TETRAAZOLE molecular structure lightbox
CAS RN: 27943-07-3

5-CYCLOPROPYL-2H-1,2,3,4-TETRAAZOLE

  • Product code: SSC-128461
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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: 1g
  • 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 27943-07-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

27943-07-3 / 5-cyclopropyl-2H-tetrazole

Standard CAS: 27943-07-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
27943-07-3
Multi CAS
No
Molecular Formula
C4H6N4
Molecular Weight
110.120000
Exact Mass
110.059246
InChI
InChI=1S/C4H6N4/c1-2-3(1)4-5-7-8-6-4/h3H,1-2H2,(H,5,6,7,8)
InChIKey
JOMBXHCJYIMCPC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
26.15
TPSA
54.46

LogP / Solubility

WLOGP
0.08
MLOGP
0.06
Consensus LogP
0.05
Log S (ESOL)
-0.97
Class (ESOL)
Very soluble
Log S (Ali)
-0.52
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.56
Class (SILICOS-IT)
Very 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)
-3.34

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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