CAS RN: 342005-82-7
Nebentan potassium
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250605 | 5mg / 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS342005-82-7
- Purity/Analytical Methods: >99.0%
342005-82-7 / potassium [6-methoxy-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-[(E)-2-phenylethenyl]sulfonylazanide
Basic Information
CAS
342005-82-7
Multi CAS
Yes
Molecular Formula
C24H20KN5O5S
Molecular Weight
529.600000
Exact Mass
529.082221
InChI
InChI=1S/C24H20N5O5S.K/c1-32-18-11-6-7-12-19(18)34-20-21(29-35(30,31)16-13-17-9-4-3-5-10-17)27-23(28-24(20)33-2)22-25-14-8-15-26-22;/h3-16H,1-2H3;/q-1;+1/b16-13+;
InChIKey
WOPWEXSDEXIRNG-ZUQRMPMESA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Aromatic heavy atom count
24
Fraction Csp3
0.08
Rotatable bonds
9
H-bond acceptors
9
Molar refractivity
130.09
TPSA
127.49
LogP / Solubility
WLOGP
1.75
MLOGP
1.58
XLogP3
1.75
Consensus LogP
1.69
Log S (ESOL)
-4.13
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.64
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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- CAS RN: 342017-94-1
- Product Code: starshine_CAS342017-94-1
- Purity/Analytical method: >99.0%
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