CAS RN: 865536-65-8
4-Oxo-N-(4-hydroxyphenyl)retinamide
Product Availability
Choose a grade to view its available package options.
5 package records1 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260311 | 1mg / 5mg / 10mg / 25mg / 100mg | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: starshine_CAS865536-65-8
- Purity/Analytical Methods: >99.0%
865536-65-8 / (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7-dimethyl-9-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)nona-2,4,6,8-tetraenamide
Basic Information
CAS
865536-65-8
Multi CAS
Yes
Molecular Formula
C26H31NO3
Molecular Weight
405.500000
Exact Mass
405.230394
InChI
InChI=1S/C26H31NO3/c1-18(9-14-23-20(3)24(29)15-16-26(23,4)5)7-6-8-19(2)17-25(30)27-21-10-12-22(28)13-11-21/h6-14,17,28H,15-16H2,1-5H3,(H,27,30)/b8-6+,14-9+,18-7+,19-17+
InChIKey
NZVOGZATHCUFRC-KFJFTADJSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
6
Fraction Csp3
0.31
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
2
Molar refractivity
123.25
TPSA
66.4
LogP / Solubility
WLOGP
6.04
MLOGP
5.34
XLogP3
5.8
Consensus LogP
5.73
Log S (ESOL)
-5.91
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.25
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.03
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 865604-33-7 IMIDAZO[1,2-A]PYRIDIN-2-AMINE, 7-BROMO- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
CMPD101
- CAS RN: 865608-11-3
- Product Code: starshine_CAS865608-11-3
- Purity/Analytical method: >99.0%
-
Takeda103A
- CAS RN: 865609-72-9
- Product Code: starshine_CAS865609-72-9
- Purity/Analytical method: >99.0%
-
Ethyl 5-(pyridin-4-yl)-1,3,4-oxadiazole-2-carboxylate
- CAS RN: 865610-89-5
- Product Code: SSC-195723
-
-
![CAS 865604-33-7 IMIDAZO[1,2-A]PYRIDIN-2-AMINE, 7-BROMO- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/865604-33-7.gif)
