![CAS 10154-42-4 (+)-4′,6′-Dimethoxy[(S)-2,3′-allylidenediphenol] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/10154-42-4.gif)
CAS RN: 10154-42-4
(+)-4′,6′-Dimethoxy[(S)-2,3′-allylidenediphenol]
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250211 | 1mg | Out of stock | Inquiry |
- Product code: starshine_CAS10154-42-4
- Purity/Analytical Methods: >99.0%
10154-42-4 / 5-[(1R)-1-(2-hydroxyphenyl)prop-2-enyl]-2,4-dimethoxyphenol
Latifolin | 5-[(1R)-1-(2-hydroxyphenyl)prop-2-enyl]-2,4-dimethoxyphenol | 5-((1R)-1-(2-hydroxyphenyl)prop-2-enyl)-2,4-dimethoxyphenol
Basic Information
CAS
10154-42-4
Multi CAS
Yes
Molecular Formula
C17H18O4
Molecular Weight
286.320000
Exact Mass
286.120509
SMILES
COC1=CC(=C(C=C1[C@H](C=C)C2=CC=CC=C2O)O)OC
InChI
InChI=1S/C17H18O4/c1-4-11(12-7-5-6-8-14(12)18)13-9-15(19)17(21-3)10-16(13)20-2/h4-11,18-19H,1H2,2-3H3/t11-/m1/s1
InChIKey
OJVQOGDGFIJYPN-LLVKDONJSA-N
Synonyms
Latifolin
5-[(1R)-1-(2-hydroxyphenyl)prop-2-enyl]-2,4-dimethoxyphenol
5-((1R)-1-(2-hydroxyphenyl)prop-2-enyl)-2,4-dimethoxyphenol
RefChem:152439
(-)-Latifolin
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.18
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
2
Molar refractivity
81.36
TPSA
58.92
LogP / Solubility
WLOGP
3.43
MLOGP
3.03
XLogP3
3.7
Consensus LogP
3.39
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.39
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.97
Class (SILICOS-IT)
Slightly 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)
-2.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3
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