![CAS 321155-13-9 N-[2-(Diphenylphosphino)benzylidene]cyclohexylamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/321155-13-9.gif)
CAS RN: 321155-13-9
N-[2-(Diphenylphosphino)benzylidene]cyclohexylamine
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.20260207 | 100mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS321155-13-9
- Purity/Analytical Methods: >99.0%
321155-13-9 / N-cyclohexyl-1-(2-diphenylphosphanylphenyl)methanimine
Basic Information
CAS
321155-13-9
Multi CAS
Yes
Molecular Formula
C25H26NP
Molecular Weight
371.500000
Exact Mass
371.180287
InChI
InChI=1S/C25H26NP/c1-4-13-22(14-5-1)26-20-21-12-10-11-19-25(21)27(23-15-6-2-7-16-23)24-17-8-3-9-18-24/h2-3,6-12,15-20,22H,1,4-5,13-14H2
InChIKey
CWYDMJZWNROFGL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
18
Fraction Csp3
0.24
Rotatable bonds
5
H-bond acceptors
1
Molar refractivity
119.62
TPSA
12.36
LogP / Solubility
WLOGP
5.2
MLOGP
4.59
XLogP3
6
Consensus LogP
5.26
Log S (ESOL)
-5.58
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.36
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.99
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)
-1.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
