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CAS 65258-53-9 1-ETHYL-1H-TETRAZOL-5-AMINE molecular structure lightbox
CAS RN: 65258-53-9

1-ETHYL-1H-TETRAZOL-5-AMINE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250917 100mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: starshine_CAS65258-53-9
  • Purity/Analytical Methods: >99.0%
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65258-53-9 / 1-ethyltetrazol-5-amine

Standard CAS: 65258-53-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
65258-53-9
Multi CAS
No
Molecular Formula
C3H7N5
Molecular Weight
113.120000
Exact Mass
113.070145
InChI
InChI=1S/C3H7N5/c1-2-8-3(4)5-6-7-8/h2H2,1H3,(H2,4,5,7)
InChIKey
WGPNLKPTYJCEKI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
27.9
TPSA
69.62

LogP / Solubility

WLOGP
-0.72
MLOGP
-0.65
XLogP3
-0.5
Consensus LogP
-0.62
Log S (ESOL)
-0.48
Class (ESOL)
Very soluble
Log S (Ali)
0.04
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.09
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-3.92

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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