CAS RN: 1065481-24-4
2-Propenamide, N-(2-fluorophenyl)-3-phenyl-, (2E)-
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.20250924 | 250mg / 1g / 5g / 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1065481-24-4
- Purity/Analytical Methods: >99.0%
1065481-24-4 / (E)-N-(2-fluorophenyl)-3-phenylprop-2-enamide
N-(2-Fluorophenyl)Cinnamamide | DTXSID80358036 | RefChem:161737
Basic Information
CAS
1065481-24-4
Multi CAS
No
Molecular Formula
C15H12FNO
Molecular Weight
241.260000
Exact Mass
241.090292
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2F
InChI
InChI=1S/C15H12FNO/c16-13-8-4-5-9-14(13)17-15(18)11-10-12-6-2-1-3-7-12/h1-11H,(H,17,18)/b11-10+
InChIKey
GFAVMCPSQILRPK-ZHACJKMWSA-N
Synonyms
N-(2-Fluorophenyl)Cinnamamide
DTXSID80358036
RefChem:161737
DTXCID70309092
MFCD02217325
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
70.51
TPSA
29.1
LogP / Solubility
WLOGP
3.48
MLOGP
3.07
XLogP3
3
Consensus LogP
3.18
Log S (ESOL)
-3.82
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.05
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.47
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.72
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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