CAS RN: 2738899-29-9
3-Pyridazinecarboxylic acid, hexahydro-, hydrochloride (1:2)
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250317 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250713 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250616 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260607 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250411 | 50mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS2738899-29-9
- Purity/Analytical Methods: >99.0%
2738899-29-9 / diazinane-3-carboxylic acid;dihydrochloride
Basic Information
CAS
2738899-29-9
Multi CAS
No
Molecular Formula
C5H12Cl2N2O2
Molecular Weight
203.060000
Exact Mass
202.027583
InChI
InChI=1S/C5H10N2O2.2ClH/c8-5(9)4-2-1-3-6-7-4;;/h4,6-7H,1-3H2,(H,8,9);2*1H
InChIKey
VZMNUIUXLIBGKR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
46.29
TPSA
61.36
LogP / Solubility
WLOGP
0.17
MLOGP
0.15
XLogP3
0.17
Consensus LogP
0.16
Log S (ESOL)
-1.14
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.24
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)
-3.84
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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