[email protected]
CAS 1346542-72-0 (5-MethylpyriMidin-2-yl)MethanaMine hydrochloride molecular structure lightbox
CAS RN: 1346542-72-0

(5-MethylpyriMidin-2-yl)MethanaMine hydrochloride

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260520 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1346542-72-0
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1346542-72-0 / (5-methylpyrimidin-2-yl)methanamine;hydrochloride

Standard CAS: 1346542-72-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1346542-72-0
Multi CAS
No
Molecular Formula
C6H10ClN3
Molecular Weight
159.620000
Exact Mass
159.056325
SMILES
CC1=CN=C(N=C1)CN.Cl
InChI
InChI=1S/C6H9N3.ClH/c1-5-3-8-6(2-7)9-4-5;/h3-4H,2,7H2,1H3;1H
InChIKey
ILVGZIDBMBUILI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
41.91
TPSA
51.8

LogP / Solubility

WLOGP
0.67
MLOGP
0.58
XLogP3
0.67
Consensus LogP
0.64
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.37
Class (SILICOS-IT)
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)
-3.22

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us