CAS RN: 644-16-6
N-(p-Tolyl)-2-naphthylamine
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.20250624 | 500mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: ICTT2065
- Purity/Analytical Methods: >98.0%(GC)
644-16-6 / N-(4-methylphenyl)naphthalen-2-amine
Basic Information
CAS
644-16-6
Multi CAS
Yes
Molecular Formula
C17H15N
Molecular Weight
233.310000
Exact Mass
233.120449
InChI
InChI=1S/C17H15N/c1-13-6-9-16(10-7-13)18-17-11-8-14-4-2-3-5-15(14)12-17/h2-12,18H,1H3
InChIKey
IBJHDUPUTZQCLL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
78.41
TPSA
12.03
LogP / Solubility
WLOGP
4.89
MLOGP
4.31
XLogP3
5.1
Consensus LogP
4.77
Log S (ESOL)
-4.89
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.48
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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- Product Code: ICTM1286
- Purity/Analytical method: >97.0%(GC)
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