CAS RN: 119425-89-7
Loureirin A
Product Availability
Choose a grade to view its available package options.
7 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250624 | 100mg | Out of stock | Inquiry | |
| Batchno.20251106 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260601 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250921 | 250mg | Out of stock | Inquiry | |
| Batchno.20250226 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250510 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260428 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS119425-89-7
- Purity/Analytical Methods: >99.0%
119425-89-7 / 3-(2,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)propan-1-one
Loureirin A | 3-(2,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)propan-1-one | DTXSID201318286
Basic Information
CAS
119425-89-7
Multi CAS
No
Molecular Formula
C17H18O4
Molecular Weight
286.320000
Exact Mass
286.120509
SMILES
COC1=CC(=C(C=C1)CCC(=O)C2=CC=C(C=C2)O)OC
InChI
InChI=1S/C17H18O4/c1-20-15-9-5-13(17(11-15)21-2)6-10-16(19)12-3-7-14(18)8-4-12/h3-5,7-9,11,18H,6,10H2,1-2H3
InChIKey
RSAIVLRELNGZEY-UHFFFAOYSA-N
Synonyms
Loureirin A
3-(2,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)propan-1-one
DTXSID201318286
RefChem:154136
DTXCID401748100
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.24
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
1
Molar refractivity
80.3
TPSA
55.76
LogP / Solubility
WLOGP
3.22
MLOGP
2.85
XLogP3
3.1
Consensus LogP
3.06
Log S (ESOL)
-3.67
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.92
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)
-2.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
LOUREIRIN B
- CAS RN: 119425-90-0
- Product Code: starshine_CAS119425-90-0
- Purity/Analytical method: >99.0%
-
Loureirin D
- CAS RN: 119425-91-1
- Product Code: starshine_CAS119425-91-1
- Purity/Analytical method: >99.0%
-
1-acetamido-3,5-dibromobenzene
- CAS RN: 119430-40-9
- Product Code: starshine_CAS119430-40-9
- Purity/Analytical method: >99.0%
-
Eliprodil
- CAS RN: 119431-25-3
- Product Code: starshine_CAS119431-25-3
- Purity/Analytical method: >99.0%
-
14(S)-Hydroxy Docosahexaenoic Acid
- CAS RN: 119433-37-3
- Product Code: starshine_CAS119433-37-3
- Purity/Analytical method: >99.0%
-
