CAS RN: 65991-91-5
2-(1H-IMIDAZOL-1-YL)ACETAMIDE
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.20251224 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS65991-91-5
- Purity/Analytical Methods: >99.0%
65991-91-5 / 2-imidazol-1-ylacetamide
Basic Information
CAS
65991-91-5
Multi CAS
No
Molecular Formula
C5H7N3O
Molecular Weight
125.130000
Exact Mass
125.058912
InChI
InChI=1S/C5H7N3O/c6-5(9)3-8-2-1-7-4-8/h1-2,4H,3H2,(H2,6,9)
InChIKey
MEAVLRNBGURMFI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
31.42
TPSA
60.91
LogP / Solubility
WLOGP
-0.63
MLOGP
-0.56
XLogP3
-0.9
Consensus LogP
-0.7
Log S (ESOL)
-0.5
Class (ESOL)
Very soluble
Log S (Ali)
-0.13
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.19
Class (SILICOS-IT)
Very 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)
-3.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
N,N,N’,N’-tetrakis(2,3-epoxypropyl)cyclohexane-1,3-dimethylamine
- CAS RN: 65992-66-7
- Product Code: starshine_CAS65992-66-7
- Purity/Analytical method: >99.0%
-
trimethoxy-[3-(2-methoxyethoxy)propyl]silane
- CAS RN: 65994-07-2
- Product Code: starshine_CAS65994-07-2
- Purity/Analytical method: >99.0%
-
-
-
-
2-BroMo-5-Methylnicotinonitrile
- CAS RN: 65996-18-1
- Product Code: starshine_CAS65996-18-1
- Purity/Analytical method: >99.0%
![CAS 65994-07-2 trimethoxy-[3-(2-methoxyethoxy)propyl]silane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/65994-07-2.gif)
