CAS RN: 60271-29-6
2-amino-5-phenylthiophene-3-carbonitrile
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250702 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260319 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250523 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20260429 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250616 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS60271-29-6
- Purity/Analytical Methods: >99.0%
60271-29-6 / 2-amino-5-phenylthiophene-3-carbonitrile
Basic Information
CAS
60271-29-6
Multi CAS
No
Molecular Formula
C11H8N2S
Molecular Weight
200.260000
Exact Mass
200.040819
InChI
InChI=1S/C11H8N2S/c12-7-9-6-10(14-11(9)13)8-4-2-1-3-5-8/h1-6H,13H2
InChIKey
WEAZGHUZIQFNLY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
58.88
TPSA
49.81
LogP / Solubility
WLOGP
2.87
MLOGP
2.52
XLogP3
3.2
Consensus LogP
2.86
Log S (ESOL)
-3.4
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.27
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.46
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)
-1.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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