CAS RN: 92823-43-3
6-Mercaptonicotinic acid
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-206689
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
92823-43-3 / 6-sulfanylidene-1H-pyridine-3-carboxylic acid
Basic Information
CAS
92823-43-3
Multi CAS
Yes
Molecular Formula
C6H5NO2S
Molecular Weight
155.180000
Exact Mass
155.004100
InChI
InChI=1S/C6H5NO2S/c8-6(9)4-1-2-5(10)7-3-4/h1-3H,(H,7,10)(H,8,9)
InChIKey
JWWGTYCXARQFOT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
38.59
TPSA
53.09
LogP / Solubility
WLOGP
1.44
MLOGP
1.26
XLogP3
0.1
Consensus LogP
0.93
Log S (ESOL)
-2.09
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.99
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 92824-09-4 Acetic acid, 2-[(7-nitro-1H-benzimidazol-2-yl)thio]- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Acetic acid, 2-[(7-nitro-1H-benzimidazol-2-yl)thio]-
- CAS RN: 92824-09-4
- Product Code: starshine_CAS92824-09-4
- Purity/Analytical method: >99.0%
-
-
-
3-(9-methoxy-7-phenethyl-7-azabicyclo[3.3.1]non-9-yl)phenol
- CAS RN: 92836-37-8
- Product Code: SSC-206714
-
-
Carbamic acid, (4-methoxyphenyl)-, phenylmethyl ester (9CI)
- CAS RN: 92851-13-3
- Product Code: SSC-206722
![CAS 92824-09-4 Acetic acid, 2-[(7-nitro-1H-benzimidazol-2-yl)thio]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/92824-09-4.gif)
![CAS 92829-83-9 8-(benzyloxy)-1,4-dioxaspiro[4.5]decane molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/92829-83-9.gif)
![CAS 92836-37-8 3-(9-methoxy-7-phenethyl-7-azabicyclo[3.3.1]non-9-yl)phenol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/92836-37-8.gif)
