![CAS 2563855-03-6 2-Propenamide, N-[3-(4-chlorophenoxy)-4-methylphenyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2563855-03-6.gif)
CAS RN: 2563855-03-6
2-Propenamide, N-[3-(4-chlorophenoxy)-4-methylphenyl]-
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260509 | 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-121797
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, 0.25g, 1g
- Available purity: ≥95%
- Inventory rows with stock: 3
- 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.
2563855-03-6 / N-[3-(4-chlorophenoxy)-4-methylphenyl]prop-2-enamide
Basic Information
CAS
2563855-03-6
Multi CAS
No
Molecular Formula
C16H14ClNO2
Molecular Weight
287.740000
Exact Mass
287.071306
InChI
InChI=1S/C16H14ClNO2/c1-3-16(19)18-13-7-4-11(2)15(10-13)20-14-8-5-12(17)6-9-14/h3-10H,1H2,2H3,(H,18,19)
InChIKey
KPXAHQSIROUBPH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.06
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
81.53
TPSA
38.33
LogP / Solubility
WLOGP
4.57
MLOGP
4.03
XLogP3
4.2
Consensus LogP
4.27
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.8
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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