CAS RN: 262368-63-8

1-[(4-AMINOPHENYL)METHYL]PIPERIDIN-4-OL(WXC08113)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250922 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS262368-63-8
  • Purity/Analytical Methods: >99.0%
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262368-63-8 / 1-[(4-aminophenyl)methyl]piperidin-4-ol

Standard CAS: 262368-63-8 Multi CAS: No

Basic Information

CAS
262368-63-8
Multi CAS
No
Molecular Formula
C12H18N2O
Molecular Weight
206.280000
Exact Mass
206.141913
InChI
InChI=1S/C12H18N2O/c13-11-3-1-10(2-4-11)9-14-7-5-12(15)6-8-14/h1-4,12,15H,5-9,13H2
InChIKey
YHULNZHMWVPUQK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
61.37
TPSA
49.49

LogP / Solubility

WLOGP
1.23
MLOGP
1.08
XLogP3
0.9
Consensus LogP
1.07
Log S (ESOL)
-2.06
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.26
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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