CAS RN: 73393-27-8
octadecyl L-tyrosinate
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.20250313 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS73393-27-8
- Purity/Analytical Methods: >99.0%
73393-27-8 / octadecyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate
Basic Information
CAS
73393-27-8
Multi CAS
Yes
Molecular Formula
C27H47NO3
Molecular Weight
433.700000
Exact Mass
433.355594
InChI
InChI=1S/C27H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-27(30)26(28)23-24-18-20-25(29)21-19-24/h18-21,26,29H,2-17,22-23,28H2,1H3/t26-/m0/s1
InChIKey
OZSVSBMHEZAZTL-SANMLTNESA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
6
Fraction Csp3
0.74
Rotatable bonds
20
H-bond acceptors
4
H-bond donors
2
Molar refractivity
130.29
TPSA
72.55
LogP / Solubility
WLOGP
7.07
MLOGP
6.25
XLogP3
9.7
Consensus LogP
7.67
Log S (ESOL)
-5.8
Class (ESOL)
Slightly soluble
Log S (Ali)
-8.22
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.74
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)
-0.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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