CAS RN: 131179-72-1
N-(4-FLUOROPHENYL)-2-(4-HYDROXYPHENYL)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.20260409 | 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS131179-72-1
- Purity/Analytical Methods: >99.0%
131179-72-1 / N-(4-fluorophenyl)-2-(4-hydroxyphenyl)acetamide
Basic Information
CAS
131179-72-1
Multi CAS
No
Molecular Formula
C14H12FNO2
Molecular Weight
245.250000
Exact Mass
245.085207
SMILES
C1=CC(=CC=C1CC(=O)NC2=CC=C(C=C2)F)O
InChI
InChI=1S/C14H12FNO2/c15-11-3-5-12(6-4-11)16-14(18)9-10-1-7-13(17)8-2-10/h1-8,17H,9H2,(H,16,18)
InChIKey
NPQFAGAPBOEXHZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
66.84
TPSA
49.33
LogP / Solubility
WLOGP
2.71
MLOGP
2.39
XLogP3
2.8
Consensus LogP
2.63
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.53
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.87
Class (SILICOS-IT)
Poorly 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)
-2.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
Efaproxiral
- CAS RN: 131179-95-8
- Product Code: starshine_CAS131179-95-8
- Purity/Analytical method: >99.0%
-
(S)-ALPHA,ALPHA-BIS(4-METHYLPHENYL)-2-PYRROLIDINEMETHANOL
- CAS RN: 131180-52-4
- Product Code: SSC-037900
-
(S)-ALPHA,ALPHA-BIS(4-METHOXYPHENYL)-2-PYRROLIDINEMETHANOL
- CAS RN: 131180-57-9
- Product Code: SSC-037901
-
(S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine
- CAS RN: 131180-63-7
- Product Code: SSC-037902
-
(S)-Tetrahydro-1,3,3-triphenyl-1H,3H-pyrrolo[1,2-c][1,3,2]oxaborole, 99% (S)-Phenyl oxazaborolidine
- CAS RN: 131180-90-0
- Product Code: starshine_CAS131180-90-0
- Purity/Analytical method: >99.0%
-
![CAS 131180-63-7 (S)-(-)-2-[Bis(3,5-dimethylphenyl)hydroxymethyl]pyrrolidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/131180-63-7.gif)
![CAS 131180-90-0 (S)-Tetrahydro-1,3,3-triphenyl-1H,3H-pyrrolo[1,2-c][1,3,2]oxaborole, 99% (S)-Phenyl oxazaborolidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/131180-90-0.gif)
