CAS RN: 1057670-48-0
2-chloro-5-(hydrazinylmethyl)pyridine
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.20260603 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1057670-48-0
- Purity/Analytical Methods: >99.0%
1057670-48-0 / (6-chloro-3-pyridinyl)methylhydrazine
2-Chloro-5-(hydrazinylmethyl)pyridine | (6-chloropyridin-3-yl)methylhydrazine | MFCD08704288
Basic Information
CAS
1057670-48-0
Multi CAS
No
Molecular Formula
C6H8ClN3
Molecular Weight
157.600000
Exact Mass
157.040675
SMILES
C1=CC(=NC=C1CNN)Cl
InChI
InChI=1S/C6H8ClN3/c7-6-2-1-5(3-9-6)4-10-8/h1-3,10H,4,8H2
InChIKey
NYNRZJAGUQREMC-UHFFFAOYSA-N
Synonyms
2-Chloro-5-(hydrazinylmethyl)pyridine
(6-chloropyridin-3-yl)methylhydrazine
MFCD08704288
(6-CHLORO-PYRIDIN-3-YLMETHYL)-HYDRAZINE
2-chloro-5-(hydrazinomethyl)pyridine
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
40.27
TPSA
50.94
LogP / Solubility
WLOGP
0.7
MLOGP
0.61
XLogP3
0.4
Consensus LogP
0.57
Log S (ESOL)
-1.57
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.5
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)
-3.19
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
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