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CAS 15562-30-8 5-METHYL-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE molecular structure lightbox
CAS RN: 15562-30-8

5-METHYL-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260316 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS15562-30-8
  • Purity/Analytical Methods: >99.0%
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15562-30-8 / 5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine

Standard CAS: 15562-30-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
15562-30-8
Multi CAS
No
Molecular Formula
C6H6N4
Molecular Weight
134.140000
Exact Mass
134.059246
SMILES
CC1=NC2=NC=NN2C=C1
InChI
InChI=1S/C6H6N4/c1-5-2-3-10-6(9-5)7-4-8-10/h2-4H,1H3
InChIKey
DOHPJVZVZNYFRH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
Fraction Csp3
0.17
H-bond acceptors
4
Molar refractivity
35.52
TPSA
43.08

LogP / Solubility

WLOGP
0.43
MLOGP
0.37
XLogP3
0.5
Consensus LogP
0.43
Log S (ESOL)
-1.61
Class (ESOL)
Soluble
Log S (Ali)
-0.97
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.89
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)
-3.23

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501

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