CAS RN: 128648-99-7
3-HYDROXY-PROPIONAMIDINE
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.20250923 | 50mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS128648-99-7
- Purity/Analytical Methods: >99.0%
128648-99-7 / 3-hydroxypropanimidamide
Basic Information
CAS
128648-99-7
Multi CAS
No
Molecular Formula
C3H8N2O
Molecular Weight
88.110000
Exact Mass
88.063663
SMILES
C(CO)C(=N)N
InChI
InChI=1S/C3H8N2O/c4-3(5)1-2-6/h6H,1-2H2,(H3,4,5)
InChIKey
PFDXDMXJMLPQIL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
3
Molar refractivity
23.62
TPSA
70.1
LogP / Solubility
WLOGP
-0.7
MLOGP
-0.63
XLogP3
-1.5
Consensus LogP
-0.94
Log S (ESOL)
0.18
Class (ESOL)
Highly soluble
Log S (Ali)
0.22
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.1
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
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)
-3.75
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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