![CAS 1326715-01-8 Thieno[2,3-c]pyridine, 5,7-dichloro- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1326715-01-8.gif)
CAS RN: 1326715-01-8
Thieno[2,3-c]pyridine, 5,7-dichloro-
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.20250422 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS1326715-01-8
- Purity/Analytical Methods: >99.0%
1326715-01-8 / 5,7-dichlorothieno[2,3-c]pyridine
Basic Information
CAS
1326715-01-8
Multi CAS
No
Molecular Formula
C7H3Cl2NS
Molecular Weight
204.080000
Exact Mass
202.936326
SMILES
C1=CSC2=C(N=C(C=C21)Cl)Cl
InChI
InChI=1S/C7H3Cl2NS/c8-5-3-4-1-2-11-6(4)7(9)10-5/h1-3H
InChIKey
NOLRRYMPZILHBM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
Molar refractivity
49.64
TPSA
12.89
LogP / Solubility
WLOGP
3.6
MLOGP
3.17
XLogP3
3.8
Consensus LogP
3.52
Log S (ESOL)
-3.98
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.83
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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