CAS RN: 864685-25-6
3-(3-Chlorophenyl)thiomorpholine
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.20250603 | 50mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS864685-25-6
- Purity/Analytical Methods: >99.0%
864685-25-6 / 3-(3-chlorophenyl)thiomorpholine
Basic Information
CAS
864685-25-6
Multi CAS
Yes
Molecular Formula
C10H12CLNS
Molecular Weight
213.730000
Exact Mass
213.037898
InChI
InChI=1S/C10H12ClNS/c11-9-3-1-2-8(6-9)10-7-13-5-4-12-10/h1-3,6,10,12H,4-5,7H2
InChIKey
VWWOSKABRMUGCB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
59.52
TPSA
12.03
LogP / Solubility
WLOGP
2.72
MLOGP
2.39
XLogP3
1.9
Consensus LogP
2.34
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.27
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.42
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)
-2.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
5-CYANO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
- CAS RN: 864685-26-7
- Product Code: SSC-195538
-
4-(4-PIPERAZIN-2-YL-PHENYL)MORPHOLINE
- CAS RN: 864685-27-8
- Product Code: starshine_CAS864685-27-8
- Purity/Analytical method: >99.0%
-
7-Fluoro-4-methoxy-benzo[b]-thiophene-2-carboxylic acid, methyl ester
- CAS RN: 864685-38-1
- Product Code: SSC-195539
-
5-(3′-HYDROXYPHENYL)-PYRIDINE-3-CARBOXAMIDE
- CAS RN: 864685-40-5
- Product Code: starshine_CAS864685-40-5
- Purity/Analytical method: >99.0%
-
2-[methyl(piperidin-4-yl)amino]ethanol(SALTDATA: 2HCl)
- CAS RN: 864710-80-5
- Product Code: SSC-195541
-
2-Propenoic acid, 1,1′-[(1E)-1,2-diazenediylbis(4,1-phenyleneoxy-9,1-nonanediyl)] ester
- CAS RN: 864711-37-5
- Product Code: SSC-195542
![CAS 864685-38-1 7-Fluoro-4-methoxy-benzo[b]-thiophene-2-carboxylic acid, methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/864685-38-1.gif)
![CAS 864710-80-5 2-[methyl(piperidin-4-yl)amino]ethanol(SALTDATA: 2HCl) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/864710-80-5.gif)
![CAS 864711-37-5 2-Propenoic acid, 1,1′-[(1E)-1,2-diazenediylbis(4,1-phenyleneoxy-9,1-nonanediyl)] ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/864711-37-5.gif)