![CAS 1346233-68-8 3,5-Dichloro-N-[[(1α,5α,6-exo,6α)-3-(3,3-diMethylbutyl)-3-azabicyclo[3.1.0]hex-6-yl]Methyl]-benzaMide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1346233-68-8.gif)
CAS RN: 1346233-68-8
3,5-Dichloro-N-[[(1α,5α,6-exo,6α)-3-(3,3-diMethylbutyl)-3-azabicyclo[3.1.0]hex-6-yl]Methyl]-benzaMide
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250610 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250430 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260101 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250930 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250721 | 5mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20260112 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1346233-68-8
- Purity/Analytical Methods: >99.0%
1346233-68-8 / 3,5-dichloro-N-[[(1R,5S)-3-(3,3-dimethylbutyl)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]benzamide
Basic Information
CAS
1346233-68-8
Multi CAS
No
Molecular Formula
C19H26Cl2N2O
Molecular Weight
369.300000
Exact Mass
368.142219
SMILES
CC(C)(C)CCN1C[C@@H]2[C@H](C1)C2CNC(=O)C3=CC(=CC(=C3)Cl)Cl
InChI
InChI=1S/C19H26Cl2N2O/c1-19(2,3)4-5-23-10-16-15(17(16)11-23)9-22-18(24)12-6-13(20)8-14(21)7-12/h6-8,15-17H,4-5,9-11H2,1-3H3,(H,22,24)/t15?,16-,17+
InChIKey
GSJIGYLGKSBYBC-ALOPSCKCSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.63
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
99.78
TPSA
32.34
LogP / Solubility
WLOGP
4.34
MLOGP
3.84
XLogP3
4.9
Consensus LogP
4.36
Log S (ESOL)
-4.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.72
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.26
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317
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