CAS RN: 7738-99-0
2-(4-chlorophenyl)thiazolidine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20260628 | 250mg | Out of stock | Inquiry |
- Product code: starshine_CAS7738-99-0
- Purity/Analytical Methods: >99.0%
7738-99-0 / 2-(4-chlorophenyl)-1,3-thiazolidine
Basic Information
CAS
7738-99-0
Multi CAS
Yes
Molecular Formula
C9H10CLNS
Molecular Weight
199.700000
Exact Mass
199.022248
InChI
InChI=1S/C9H10ClNS/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4,9,11H,5-6H2
InChIKey
CRGIYWDTHYLXNH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
54.65
TPSA
12.03
LogP / Solubility
WLOGP
2.68
MLOGP
2.35
XLogP3
2.1
Consensus LogP
2.38
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.13
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly 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)
-2.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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- CAS RN: 7745-89-3
- Product Code: starshine_CAS7745-89-3
- Purity/Analytical method: >99.0%
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