CAS RN: 66592-89-0
CarbaMiMidothioic acid, 3-cyanopropyl ester, hydrochloride (1:1)
Product Availability
Choose a grade to view its available package options.
9 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250415 | 10mg / 50mg / 100mg / 250mg | Confirm by inquiry | Shanghai, Hebei | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250704 | 100mg | Out of stock | Inquiry | ||
| Batchno.20250303 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250401 | 1g | Out of stock | Inquiry | ||
| Batchno.20250104 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20260623 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250918 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250526 | 50mg | Out of stock | Inquiry | ||
| Batchno.20260411 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS66592-89-0
- Purity/Analytical Methods: >99.0%
66592-89-0 / 3-cyanopropyl carbamimidothioate;hydrochloride
Basic Information
CAS
66592-89-0
Multi CAS
No
Molecular Formula
C5H10CLN3S
Molecular Weight
179.670000
Exact Mass
179.028396
InChI
InChI=1S/C5H9N3S.ClH/c6-3-1-2-4-9-5(7)8;/h1-2,4H2,(H3,7,8);1H
InChIKey
NCXJZJFDQMKRKM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.6
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
46.47
TPSA
73.66
LogP / Solubility
WLOGP
1.34
MLOGP
1.18
XLogP3
1.34
Consensus LogP
1.29
Log S (ESOL)
-1.6
Class (ESOL)
Soluble
Log S (Ali)
-2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.3
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)
-2.87
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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