CAS RN: 604-60-4
2,2′-binaphthyl-1,1′-diol
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250705 | 25g | Out of stock | Inquiry |
- Product code: starshine_CAS604-60-4
- Purity/Analytical Methods: >99.0%
604-60-4 / 2-(1-hydroxynaphthalen-2-yl)naphthalen-1-ol
Basic Information
CAS
604-60-4
Multi CAS
Yes
Molecular Formula
C20H14O2
Molecular Weight
286.300000
Exact Mass
286.099380
InChI
InChI=1S/C20H14O2/c21-19-15-7-3-1-5-13(15)9-11-17(19)18-12-10-14-6-2-4-8-16(14)20(18)22/h1-12,21-22H
InChIKey
AGUJUBACOOIWDV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
20
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
90.22
TPSA
40.46
LogP / Solubility
WLOGP
5.07
MLOGP
4.47
XLogP3
5.3
Consensus LogP
4.95
Log S (ESOL)
-5.42
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.57
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.85
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
No
Log Kp (skin permeation)
-0.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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