CAS RN: 5699-40-1
1-Acetylguanidine
Product Availability
Choose a grade to view its available package options.
11 package records11 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250818 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20260226 | 1kg | In stock | Shanghai | Inquiry |
| Batchno.20260630 | 25g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20260418 | 500g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20260123 | 5g | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250320 | 5g / 25g / 100g / 500g | Confirm by inquiry | Shanghai, Shandong, Guangdong | Inquiry |
- Product code: ICTA3124
- Purity/Analytical Methods: >98.0%(T)
5699-40-1 / N-(diaminomethylidene)acetamide
Basic Information
CAS
5699-40-1
Multi CAS
Yes
Molecular Formula
C3H7N3O
Molecular Weight
101.110000
Exact Mass
101.058912
InChI
InChI=1S/C3H7N3O/c1-2(7)6-3(4)5/h1H3,(H4,4,5,6,7)
InChIKey
NGGXACLSAZXJGM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
0.33
H-bond acceptors
1
H-bond donors
2
Molar refractivity
26.49
TPSA
81.47
LogP / Solubility
WLOGP
-1.19
MLOGP
-1.06
XLogP3
-0.8
Consensus LogP
-1.02
Log S (ESOL)
0.29
Class (ESOL)
Highly soluble
Log S (Ali)
0.47
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.67
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.18
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
