CAS RN: 52550-86-4
Azobenzene-4,4′-biscarbaldehyde
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250508 | 250mg | Out of stock | Inquiry |
- Product code: starshine_CAS52550-86-4
- Purity/Analytical Methods: >99.0%
52550-86-4 / 4-[(4-formylphenyl)diazenyl]benzaldehyde
Basic Information
CAS
52550-86-4
Multi CAS
No
Molecular Formula
C14H10N2O2
Molecular Weight
238.240000
Exact Mass
238.074228
InChI
InChI=1S/C14H10N2O2/c17-9-11-1-5-13(6-2-11)15-16-14-7-3-12(10-18)4-8-14/h1-10H
InChIKey
QRHDFPNRGBRHTC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
12
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
67.84
TPSA
58.86
LogP / Solubility
WLOGP
3.73
MLOGP
3.28
XLogP3
2.6
Consensus LogP
3.2
Log S (ESOL)
-3.89
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.2
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.78
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.53
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
H-TYR-PNA
- CAS RN: 52551-07-2
- Product Code: starshine_CAS52551-07-2
- Purity/Analytical method: >99.0%
-
-
-
2′-DEOXYGUANOSINE-5′-MONOPHOSPHATE DISODIUM SALT
- CAS RN: 52558-16-4
- Product Code: starshine_CAS52558-16-4
- Purity/Analytical method: >99.0%
-
Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-, (2R)-
- CAS RN: 52558-23-3
- Product Code: SSC-159673
-
Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-, (2S)-
- CAS RN: 52558-24-4
- Product Code: SSC-159674
![CAS 52558-23-3 Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-, (2R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52558-23-3.gif)
![CAS 52558-24-4 Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-, (2S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/52558-24-4.gif)