CAS RN: 1060815-16-8
C-(4,6-Dichloro-pyridin-2-yl)-MethylaMine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260530 | 100mg / 250mg / 500mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1060815-16-8
- Purity/Analytical Methods: >99.0%
1060815-16-8 / (4,6-dichloro-2-pyridinyl)methanamine
(4,6-DICHLOROPYRIDIN-2-YL)METHANAMINE | MFCD10698619 | C-(4,6-DICHLORO-PYRIDIN-2-YL)-METHYLAMINE
Basic Information
CAS
1060815-16-8
Multi CAS
No
Molecular Formula
C6H6Cl2N2
Molecular Weight
177.030000
Exact Mass
175.990804
SMILES
C1=C(C=C(N=C1CN)Cl)Cl
InChI
InChI=1S/C6H6Cl2N2/c7-4-1-5(3-9)10-6(8)2-4/h1-2H,3,9H2
InChIKey
MLZPDLJHFHXQHI-UHFFFAOYSA-N
Synonyms
(4,6-DICHLOROPYRIDIN-2-YL)METHANAMINE
MFCD10698619
C-(4,6-DICHLORO-PYRIDIN-2-YL)-METHYLAMINE
1-(4,6-dichloropyridin-2-yl)methanamine
SCHEMBL19534265
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
42.15
TPSA
38.91
LogP / Solubility
WLOGP
1.85
MLOGP
1.62
XLogP3
1.3
Consensus LogP
1.59
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
Class (SILICOS-IT)
Moderately 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)
-2.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
