CAS RN: 6659-45-6
1′,2′-dihydrorotenone
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251125 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260221 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250606 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260602 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260603 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250314 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS6659-45-6
- Purity/Analytical Methods: >99.0%
6659-45-6 / (1R,6S,13R)-16,17-dimethoxy-6-propan-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
Basic Information
CAS
6659-45-6
Multi CAS
Yes
Molecular Formula
C23H24O6
Molecular Weight
396.400000
Exact Mass
396.157288
InChI
InChI=1S/C23H24O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,11,16,20-21H,8,10H2,1-4H3/t16-,20-,21+/m0/s1
InChIKey
DTFARBHXORYQBF-ORYQWCPZSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
3
H-bond acceptors
6
Molar refractivity
105.93
TPSA
63.22
LogP / Solubility
WLOGP
3.78
MLOGP
3.35
XLogP3
4.2
Consensus LogP
3.78
Log S (ESOL)
-4.79
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.54
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.74
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
Yes
Log Kp (skin permeation)
-2.45
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
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