![CAS 65113-25-9 1-[4-(1H-Imidazol-1-yl)phenyl]methanamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/65113-25-9.gif)
CAS RN: 65113-25-9
1-[4-(1H-Imidazol-1-yl)phenyl]methanamine
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.20250530 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS65113-25-9
- Purity/Analytical Methods: >99.0%
65113-25-9 / (4-imidazol-1-ylphenyl)methanamine
Basic Information
CAS
65113-25-9
Multi CAS
Yes
Molecular Formula
C10H11N3
Molecular Weight
173.210000
Exact Mass
173.095297
InChI
InChI=1S/C10H11N3/c11-7-9-1-3-10(4-2-9)13-6-5-12-8-13/h1-6,8H,7,11H2
InChIKey
MACCCEHTOQDLIP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
11
Fraction Csp3
0.1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
51.46
TPSA
43.84
LogP / Solubility
WLOGP
1.33
MLOGP
1.17
XLogP3
0.5
Consensus LogP
1
Log S (ESOL)
-2.25
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.13
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)
-2.83
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
-
3-Chloro-5-hydroxy-7-methoxynaphthoquinone
- CAS RN: 65120-69-6
- Product Code: starshine_CAS65120-69-6
- Purity/Analytical method: >99.0%
-
N-(ForMyl aMidino)-N-β-D-ribofuranosylurea
- CAS RN: 65126-88-7
- Product Code: starshine_CAS65126-88-7
- Purity/Analytical method: >99.0%
-
Z-7-TETRADECENAL
- CAS RN: 65128-96-3
- Product Code: starshine_CAS65128-96-3
- Purity/Analytical method: >99.0%
-
-
-
