CAS RN: 392330-26-6
6-chloro-2-naphthalenethiol
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.20250714 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS392330-26-6
- Purity/Analytical Methods: >99.0%
392330-26-6 / 6-chloronaphthalene-2-thiol
Basic Information
CAS
392330-26-6
Multi CAS
No
Molecular Formula
C10H7CLS
Molecular Weight
194.680000
Exact Mass
193.995699
InChI
InChI=1S/C10H7ClS/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,12H
InChIKey
UNDQDTFBOZKROF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
10
H-bond acceptors
1
H-bond donors
1
Molar refractivity
56.21
TPSA
1.0000
LogP / Solubility
WLOGP
3.78
MLOGP
3.33
XLogP3
4.3
Consensus LogP
3.8
Log S (ESOL)
-4.05
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.89
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.06
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.22
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
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