CAS RN: 52452-60-5
TERPHENYLLIN
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.20260107 | 1mg / 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS52452-60-5
- Purity/Analytical Methods: >99.0%
52452-60-5 / 2,5-bis(4-hydroxyphenyl)-3,6-dimethoxyphenol
Basic Information
CAS
52452-60-5
Multi CAS
No
Molecular Formula
C20H18O5
Molecular Weight
338.400000
Exact Mass
338.115424
InChI
InChI=1S/C20H18O5/c1-24-17-11-16(12-3-7-14(21)8-4-12)20(25-2)19(23)18(17)13-5-9-15(22)10-6-13/h3-11,21-23H,1-2H3
InChIKey
YNEMPXKRLPZFAX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
3
Molar refractivity
95.41
TPSA
79.15
LogP / Solubility
WLOGP
4.15
MLOGP
3.67
XLogP3
4.1
Consensus LogP
3.97
Log S (ESOL)
-4.82
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.33
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
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
2-aminothiazol-5-acetic acid
- CAS RN: 52454-66-7
- Product Code: starshine_CAS52454-66-7
- Purity/Analytical method: >99.0%
-
L-Glutamic acid 1-ethyl ester
- CAS RN: 52454-78-1
- Product Code: starshine_CAS52454-78-1
- Purity/Analytical method: >99.0%
-
1H-Benzimidazole,1-methyl-2-(1-methylethyl)-(9CI)
- CAS RN: 52460-28-3
- Product Code: SSC-159564
-
-
2,3,6-Trichloro-5-(chloromethyl)pyridine
- CAS RN: 52465-59-5
- Product Code: starshine_CAS52465-59-5
- Purity/Analytical method: >99.0%
