![CAS 1305320-62-0 2,4-Dichloro-β-[(2,6-dichlorophenyl)methoxy]benzeneethanamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1305320-62-0.gif)
CAS RN: 1305320-62-0
2,4-Dichloro-β-[(2,6-dichlorophenyl)methoxy]benzeneethanamine
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.20260309 | 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-037152
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 1g, 0.25g
- Available purity: >95%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
1305320-62-0 / 2-(2,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methoxy]ethanamine
Basic Information
CAS
1305320-62-0
Multi CAS
No
Molecular Formula
C15H13Cl4NO
Molecular Weight
365.100000
Exact Mass
364.972175
SMILES
C1=CC(=C(C(=C1)Cl)COC(CN)C2=C(C=C(C=C2)Cl)Cl)Cl
InChI
InChI=1S/C15H13Cl4NO/c16-9-4-5-10(14(19)6-9)15(7-20)21-8-11-12(17)2-1-3-13(11)18/h1-6,15H,7-8,20H2
InChIKey
YEFWMFSHHWNWBA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.2
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
89.51
TPSA
35.25
LogP / Solubility
WLOGP
5.52
MLOGP
4.87
XLogP3
4.7
Consensus LogP
5.03
Log S (ESOL)
-5.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.54
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.21
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.03
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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