CAS RN: 49834-29-9
N-t-butyl-4-fluorobenzamide
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.20260627 | 25g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS49834-29-9
- Purity/Analytical Methods: >99.0%
49834-29-9 / N-tert-butyl-4-fluorobenzamide
Basic Information
CAS
49834-29-9
Multi CAS
No
Molecular Formula
C11FH14NO
Molecular Weight
195.230000
Exact Mass
195.105942
InChI
InChI=1S/C11H14FNO/c1-11(2,3)13-10(14)8-4-6-9(12)7-5-8/h4-7H,1-3H3,(H,13,14)
InChIKey
ZMYTVKMZSNODPU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
53.62
TPSA
29.1
LogP / Solubility
WLOGP
2.35
MLOGP
2.07
XLogP3
2.3
Consensus LogP
2.24
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.86
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
Class (SILICOS-IT)
Poorly 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)
-2.24
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
-
![CAS 49834-62-0 1H-PYRAZOLO[3,4-B]PYRIDIN-4-AMINE molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
-
-
-
3,3′-diiodo-2,2′-dimethoxy-5,5′,6,6′,7,7′,8,8′-octahydro-1,1′-binaphthalene
- CAS RN: 400027-47-6
- Product Code: starshine_CAS400027-47-6
- Purity/Analytical method: >99.0%
-
R-5,5′,6,6′,7,7′,8,8′-octahydro-3,3′-bis(2,4,6-triMethylphenyl)-[1,1′-Binaphthalene]-2,2′-diol
- CAS RN: 400027-51-2
- Product Code: SSC-147867
![CAS 49834-62-0 1H-PYRAZOLO[3,4-B]PYRIDIN-4-AMINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/49834-62-0.gif)
![CAS 49834-67-5 1H-pyrazolo[3,4-b]pyridin-4(7H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/49834-67-5.gif)
![CAS 400027-51-2 R-5,5′,6,6′,7,7′,8,8′-octahydro-3,3′-bis(2,4,6-triMethylphenyl)-[1,1′-Binaphthalene]-2,2′-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/400027-51-2.gif)