![CAS 690635-45-1 4-aMino-2-broMo-thieno[3,2-c]pyridine-7-carboxylic acid aMide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/690635-45-1.gif)
CAS RN: 690635-45-1
4-aMino-2-broMo-thieno[3,2-c]pyridine-7-carboxylic acid aMide
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.20260425 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS690635-45-1
- Purity/Analytical Methods: >99.0%
690635-45-1 / 4-amino-2-bromothieno[3,2-c]pyridine-7-carboxamide
Basic Information
CAS
690635-45-1
Multi CAS
No
Molecular Formula
BC8H6ORn3S
Molecular Weight
272.120000
Exact Mass
270.941500
InChI
InChI=1S/C8H6BrN3OS/c9-5-1-3-6(14-5)4(8(11)13)2-12-7(3)10/h1-2H,(H2,10,12)(H2,11,13)
InChIKey
KBJKAURPHBWEOT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
60.25
TPSA
82
LogP / Solubility
WLOGP
1.74
MLOGP
1.54
XLogP3
1.4
Consensus LogP
1.56
Log S (ESOL)
-3.03
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.05
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.99
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.14
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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