![CAS 354124-90-6 [2-(4-Fluoro-phenylamino)-thiazol-4-yl]-acetic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/354124-90-6(2).gif)
CAS RN: 354124-90-6
[2-(4-Fluoro-phenylamino)-thiazol-4-yl]-acetic acid
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.20250204 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS354124-90-6
- Purity/Analytical Methods: >99.0%
354124-90-6 / 2-[2-(4-fluoroanilino)-1,3-thiazol-4-yl]acetic acid
Basic Information
CAS
354124-90-6
Multi CAS
No
Molecular Formula
C11FH9N2O2S
Molecular Weight
252.270000
Exact Mass
252.036877
InChI
InChI=1S/C11H9FN2O2S/c12-7-1-3-8(4-2-7)13-11-14-9(6-17-11)5-10(15)16/h1-4,6H,5H2,(H,13,14)(H,15,16)
InChIKey
DKMOQDZYPOFTDL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
11
Fraction Csp3
0.09
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
63.14
TPSA
62.22
LogP / Solubility
WLOGP
2.65
MLOGP
2.34
XLogP3
2.4
Consensus LogP
2.46
Log S (ESOL)
-3.29
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.54
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 354126-20-8 N-{2-[(4-chlorobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-(morpholin-4-ylcarbonyl)benzamide molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
N-{2-[(4-chlorobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-(morpholin-4-ylcarbonyl)benzamide
- CAS RN: 354126-20-8
- Product Code: starshine_CAS354126-20-8
- Purity/Analytical method: >99.0%
-
4-chloro-N-cyclopropylbenzenesulfonamide
- CAS RN: 354128-89-5
- Product Code: starshine_CAS354128-89-5
- Purity/Analytical method: >99.0%
-
-
-
-
Trans-Benzyl 2-(Bromomethyl)Hexahydrofuro[2,3-C]Pyridine-6(2H)-Carboxylate
- CAS RN: 354154-95-3
- Product Code: starshine_CAS354154-95-3
- Purity/Analytical method: >99.0%
![CAS 354126-20-8 N-{2-[(4-chlorobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-(morpholin-4-ylcarbonyl)benzamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/354126-20-8(2).gif)
.gif)
.gif)
.gif)
.gif)
![CAS 354154-95-3 Trans-Benzyl 2-(Bromomethyl)Hexahydrofuro[2,3-C]Pyridine-6(2H)-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/354154-95-3(2).gif)