CAS RN: 151649-34-2
6-Prenylquercetin-3-methylether
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.20250327 | 5mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS151649-34-2
- Purity/Analytical Methods: >99.0%
151649-34-2 / 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-6-(3-methylbut-2-enyl)chromen-4-one
Basic Information
CAS
151649-34-2
Multi CAS
No
Molecular Formula
C21H20O7
Molecular Weight
384.400000
Exact Mass
384.120903
SMILES
CC(=CCC1=C(C2=C(C=C1O)OC(=C(C2=O)OC)C3=CC(=C(C=C3)O)O)O)C
InChI
InChI=1S/C21H20O7/c1-10(2)4-6-12-14(23)9-16-17(18(12)25)19(26)21(27-3)20(28-16)11-5-7-13(22)15(24)8-11/h4-5,7-9,22-25H,6H2,1-3H3
InChIKey
XREZFYPTHFWMDM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
16
Fraction Csp3
0.19
Rotatable bonds
4
H-bond acceptors
7
H-bond donors
4
Molar refractivity
104.27
TPSA
120.36
LogP / Solubility
WLOGP
3.8
MLOGP
3.37
XLogP3
4.4
Consensus LogP
3.86
Log S (ESOL)
-4.78
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.46
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.79
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
Yes
Log Kp (skin permeation)
-2.37
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 151657-13-5 4-SULFOCALIX[4]ARENE SODIUM SALT molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
4-SULFOCALIX[4]ARENE SODIUM SALT
- CAS RN: 151657-13-5
- Product Code: starshine_CAS151657-13-5
- Purity/Analytical method: >99.0%
-
6H-Pyrido[1,2-a]pyrazin-6-one,octahydro-(9CI)
- CAS RN: 151665-85-9
- Product Code: SSC-061485
-
3-PHENOXYPIPERIDINE
- CAS RN: 151666-08-9
- Product Code: starshine_CAS151666-08-9
- Purity/Analytical method: >99.0%
-
-
2,6-Bis[(4S)-benzyl-2-oxazolin-2-yl]pyridine
- CAS RN: 151670-69-8
- Product Code: SSC-061490
-
TETRAETHYL(3-HYDROXYPROPYLIDENE)BISPHOSPHONATE
- CAS RN: 151671-10-2
- Product Code: SSC-061493
![CAS 151657-13-5 4-SULFOCALIX[4]ARENE SODIUM SALT molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/151657-13-5.gif)
![CAS 151665-85-9 6H-Pyrido[1,2-a]pyrazin-6-one,octahydro-(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/151665-85-9.gif)
![CAS 151670-69-8 2,6-Bis[(4S)-benzyl-2-oxazolin-2-yl]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/151670-69-8.gif)
