![CAS 930784-56-8 (1R)- 6,6′-bis(3,5-diMethylphenyl)-2,2′,3,3′-tetrahydro-1,1′-Spirobi[1H-indene]-7,7′-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/930784-56-8.gif)
CAS RN: 930784-56-8
(1R)- 6,6′-bis(3,5-diMethylphenyl)-2,2′,3,3′-tetrahydro-1,1′-Spirobi[1H-indene]-7,7′-diol
Product Availability
Choose a grade to view its available package options.
5 package records2 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250604 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS930784-56-8
- Purity/Analytical Methods: >99.0%
930784-56-8 / 5,5'-bis(3,5-dimethylphenyl)-3,3'-spirobi[1,2-dihydroindene]-4,4'-diol
Basic Information
CAS
930784-56-8
Multi CAS
No
Molecular Formula
C33H32O2
Molecular Weight
460.600000
Exact Mass
460.240230
InChI
InChI=1S/C33H32O2/c1-19-13-20(2)16-25(15-19)27-7-5-23-9-11-33(29(23)31(27)34)12-10-24-6-8-28(32(35)30(24)33)26-17-21(3)14-22(4)18-26/h5-8,13-18,34-35H,9-12H2,1-4H3
InChIKey
UKPYMPGAROWSMA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
24
Fraction Csp3
0.27
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
143.46
TPSA
40.46
LogP / Solubility
WLOGP
7.84
MLOGP
6.93
XLogP3
8.8
Consensus LogP
7.86
Log S (ESOL)
-8.01
Class (ESOL)
Insoluble
Log S (Ali)
-9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.4
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
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