CAS RN: 478-61-5
BERBAMINE
Product Availability
Choose a grade to view its available package options.
8 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251101 | 100mg | In stock | Shanghai, Shandong | Inquiry | |
| Batchno.20251112 | 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250222 | 250mg | In stock | Shandong | Inquiry | |
| Batchno.20260507 | 25mg | In stock | Shanghai, Shandong, Guangdong | Inquiry | |
| Batchno.20250131 | 5mg | In stock | Shanghai, Shandong, Chongqing | Inquiry |
- Product code: starshine_CAS478-61-5
- Purity/Analytical Methods: >99.0%
478-61-5 / 20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
Basic Information
CAS
478-61-5
Multi CAS
Yes
Molecular Formula
C37H40N2O6
Molecular Weight
608.700000
Exact Mass
608.288637
InChI
InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3
InChIKey
DFOCUWZXJBAUSQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
45
Aromatic heavy atom count
24
Fraction Csp3
0.35
Rotatable bonds
3
H-bond acceptors
8
H-bond donors
1
Molar refractivity
172.79
TPSA
72.86
LogP / Solubility
WLOGP
6.86
MLOGP
6.09
XLogP3
6.1
Consensus LogP
6.35
Log S (ESOL)
-8.13
Class (ESOL)
Insoluble
Log S (Ali)
-9.5
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.67
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.56
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10
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