![CAS 265116-85-6 3,3”-[OXYBIS(METHYLENE)]BIS-(1R,1”R)-1,1”-BI-2-NAPHTHOL molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/265116-85-6.gif)
CAS RN: 265116-85-6
3,3”-[OXYBIS(METHYLENE)]BIS-(1R,1”R)-1,1”-BI-2-NAPHTHOL
Product Availability
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5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260119 | 100mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250625 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260312 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260422 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250322 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS265116-85-6
- Purity/Analytical Methods: >99.0%
265116-85-6 / 3-[[3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]methoxymethyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
Basic Information
CAS
265116-85-6
Multi CAS
No
Molecular Formula
C42H30O5
Molecular Weight
614.700000
Exact Mass
614.209324
SMILES
C1=CC=C2C(=C1)C=CC(=C2C3=C(C(=CC4=CC=CC=C43)COCC5=CC6=CC=CC=C6C(=C5O)C7=C(C=CC8=CC=CC=C87)O)O)O
InChI
InChI=1S/C42H30O5/c43-35-19-17-25-9-1-5-13-31(25)37(35)39-33-15-7-3-11-27(33)21-29(41(39)45)23-47-24-30-22-28-12-4-8-16-34(28)40(42(30)46)38-32-14-6-2-10-26(32)18-20-36(38)44/h1-22,43-46H,23-24H2
InChIKey
UZZFMCDREAEXRS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
47
Aromatic heavy atom count
40
Fraction Csp3
0.05
Rotatable bonds
6
H-bond acceptors
5
H-bond donors
4
Molar refractivity
188.93
TPSA
90.15
LogP / Solubility
WLOGP
10.17
MLOGP
9
XLogP3
9.9
Consensus LogP
9.69
Log S (ESOL)
-10.29
Class (ESOL)
Insoluble
Log S (Ali)
-11.95
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.82
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.75
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6.5
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