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CAS 55095-20-0 1-(3-methylphenyl)-1-phenylmethanamine(SALTDATA: HCl) molecular structure lightbox
CAS RN: 55095-20-0

1-(3-methylphenyl)-1-phenylmethanamine(SALTDATA: HCl)

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260615 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS55095-20-0
  • Purity/Analytical Methods: >99.0%
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55095-20-0 / (3-methylphenyl)-phenylmethanamine

Standard CAS: 55095-20-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
55095-20-0
Multi CAS
No
Molecular Formula
C14H15N
Molecular Weight
197.270000
Exact Mass
197.120449
InChI
InChI=1S/C14H15N/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h2-10,14H,15H2,1H3
InChIKey
OLWWNHQOJUELFD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
63.65
TPSA
26.02

LogP / Solubility

WLOGP
3.04
MLOGP
2.68
XLogP3
2.8
Consensus LogP
2.84
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.37
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.71
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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