CAS RN: 6285-28-5

3,5-DIETHYL-1,2,4-TRIAZOL-4-YLAMINE

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1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251230 500mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS6285-28-5
  • Purity/Analytical Methods: >99.0%
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6285-28-5 / 3,5-diethyl-1,2,4-triazol-4-amine

Standard CAS: 6285-28-5 Multi CAS: Yes

Basic Information

CAS
6285-28-5
Multi CAS
Yes
Molecular Formula
C6H12N4
Molecular Weight
140.190000
Exact Mass
140.106196
InChI
InChI=1S/C6H12N4/c1-3-5-8-9-6(4-2)10(5)7/h3-4,7H2,1-2H3
InChIKey
PLSFAHFBTFAYIR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
38.93
TPSA
56.73

LogP / Solubility

WLOGP
0.12
MLOGP
0.1
XLogP3
0.8
Consensus LogP
0.34
Log S (ESOL)
-1.02
Class (ESOL)
Soluble
Log S (Ali)
-0.79
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.91
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)
-3.49

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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