CAS RN: 21542-82-5
Acid yellow 10
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.20250529 | 200mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS21542-82-5
- Purity/Analytical Methods: >99.0%
21542-82-5 / 2-hydroxy-5-[(4-sulfophenyl)diazenyl]benzoic acid
Basic Information
CAS
21542-82-5
Multi CAS
No
Molecular Formula
C13H10N2O6S
Molecular Weight
322.300000
Exact Mass
322.025957
SMILES
C1=CC(=CC=C1N=NC2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)O
InChI
InChI=1S/C13H10N2O6S/c16-12-6-3-9(7-11(12)13(17)18)15-14-8-1-4-10(5-2-8)22(19,20)21/h1-7,16H,(H,17,18)(H,19,20,21)
InChIKey
MXCDRFGKHNFKIP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
12
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
3
Molar refractivity
75.5
TPSA
136.62
LogP / Solubility
WLOGP
2.75
MLOGP
2.44
XLogP3
-1.7
Consensus LogP
1.16
Log S (ESOL)
-3.71
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.19
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.73
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
R-3-3′-Bis(3,5-bis(methyl)phenyl)-1,1′-bi-2-naphthol
- CAS RN: 215433-51-5
- Product Code: SSC-103231
-
R-3,3′-bis([1,1′-biphenyl]-4-yl)-1,1′-Binaphthalene]-2,2′-diol
- CAS RN: 215433-52-6
- Product Code: starshine_CAS215433-52-6
- Purity/Analytical method: >99.0%
-
(1’R)- [2,3′:1′,1”:3”,2”’-Quaternaphthalene]-2′,2”-diol
- CAS RN: 215433-53-7
- Product Code: SSC-103232
-
9,10[1′,2′]-Benzenoanthracene-9,10-dicarboxylic acid
- CAS RN: 21543-36-2
- Product Code: starshine_CAS21543-36-2
- Purity/Analytical method: >99.0%
-
2-[4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDYL]PIPERAZINO]ETHAN-1-OL
- CAS RN: 215434-40-5
- Product Code: starshine_CAS215434-40-5
- Purity/Analytical method: >99.0%
![CAS 215433-52-6 R-3,3′-bis([1,1′-biphenyl]-4-yl)-1,1′-Binaphthalene]-2,2′-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/215433-52-6.gif)
![CAS 215433-53-7 (1’R)- [2,3′:1′,1”:3”,2”’-Quaternaphthalene]-2′,2”-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/215433-53-7.gif)
![CAS 21543-36-2 9,10[1′,2′]-Benzenoanthracene-9,10-dicarboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/21543-36-2.gif)
![CAS 215434-40-5 2-[4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDYL]PIPERAZINO]ETHAN-1-OL molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/215434-40-5.gif)