CAS RN: 324047-70-3
(1R,2R)- 1,2-diphenyl-N-(phenylMethyl)-1,2-EthanediaMine
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.20250403 | 50mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS324047-70-3
- Purity/Analytical Methods: >99.0%
324047-70-3 / N'-benzyl-1,2-diphenylethane-1,2-diamine
Basic Information
CAS
324047-70-3
Multi CAS
Yes
Molecular Formula
C21H22N2
Molecular Weight
302.400000
Exact Mass
302.178299
InChI
InChI=1S/C21H22N2/c22-20(18-12-6-2-7-13-18)21(19-14-8-3-9-15-19)23-16-17-10-4-1-5-11-17/h1-15,20-21,23H,16,22H2/t20-,21-/m1/s1
InChIKey
OSNKTPRQRNOZIK-NHCUHLMSSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
18
Fraction Csp3
0.14
Rotatable bonds
6
H-bond acceptors
2
H-bond donors
2
Molar refractivity
95.84
TPSA
38.05
LogP / Solubility
WLOGP
4.22
MLOGP
3.72
XLogP3
3.4
Consensus LogP
3.78
Log S (ESOL)
-4.56
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.08
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.85
Class (SILICOS-IT)
Slightly soluble
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
No
Log Kp (skin permeation)
-1.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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