![CAS 936074-66-7 3-Phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/936074-66-7.gif)
CAS RN: 936074-66-7
3-Phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic 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.20250617 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS936074-66-7
- Purity/Analytical Methods: >99.0%
936074-66-7 / 3-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
Basic Information
CAS
936074-66-7
Multi CAS
No
Molecular Formula
C13H9N3O2
Molecular Weight
239.230000
Exact Mass
239.069477
InChI
InChI=1S/C13H9N3O2/c17-13(18)10-6-7-11-14-15-12(16(11)8-10)9-4-2-1-3-5-9/h1-8H,(H,17,18)
InChIKey
PSZVQTSHDZGTBX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
15
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
65.38
TPSA
67.49
LogP / Solubility
WLOGP
2.09
MLOGP
1.85
XLogP3
2.4
Consensus LogP
2.11
Log S (ESOL)
-3.13
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.03
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.19
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)
-2.69
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
-
![CAS 936091-14-4 N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
- CAS RN: 936091-14-4
- Product Code: starshine_CAS936091-14-4
- Purity/Analytical method: >99.0%
-
N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
- CAS RN: 936091-26-8
- Product Code: starshine_CAS936091-26-8
- Purity/Analytical method: >99.0%
-
N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[3-(4-morpholinylmethyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
- CAS RN: 936091-56-4
- Product Code: starshine_CAS936091-56-4
- Purity/Analytical method: >99.0%
-
N-tert-butyl-3-(2-chloro-5-methylpyrimidin-4-ylamino)benzenesulfonamide
- CAS RN: 936092-53-4
- Product Code: SSC-207918
-
-
![CAS 936091-14-4 N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/936091-14-4.gif)
![CAS 936091-26-8 N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/936091-26-8.gif)
![CAS 936091-56-4 N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[3-(4-morpholinylmethyl)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/936091-56-4.gif)
