![CAS 942135-14-0 4-(4-Methoxyphenyl)thieno[2,3-b:5,4-c’]dipyridine-2-carboxamide molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m3085-jpgcontextbwfzdgvyfhjvb3r8mzkxmtn8aw1hz2uvanblz3xontyvada1lzg5mze2mty4odi3mtgvttmwoduuanbnfdnjmwmzntg5ztmxoduxnta1ztjjm2zkogezyzdmndy4m2y3njdiotm4yzmznjhimznhzje0zwe4yzzkztu2zdy.jpeg)
CAS RN: 942135-14-0
4-(4-Methoxyphenyl)thieno[2,3-b:5,4-c’]dipyridine-2-carboxamide
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.20260625 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: ICTM3085
- Purity/Analytical Methods: >98.0%(HPLC)
942135-14-0 / 13-(4-methoxyphenyl)-8-thia-5,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-11-carboxamide
Basic Information
CAS
942135-14-0
Multi CAS
No
Molecular Formula
C18H13N3O2S
Molecular Weight
335.400000
Exact Mass
335.072848
InChI
InChI=1S/C18H13N3O2S/c1-23-11-4-2-10(3-5-11)13-8-14(17(19)22)21-18-16(13)12-6-7-20-9-15(12)24-18/h2-9H,1H3,(H2,19,22)
InChIKey
NAQZGMVCADAKFA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
19
Fraction Csp3
0.06
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
1
Molar refractivity
95.43
TPSA
78.1
LogP / Solubility
WLOGP
3.62
MLOGP
3.2
XLogP3
3.3
Consensus LogP
3.37
Log S (ESOL)
-4.59
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.92
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.2
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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