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CAS 151140-92-0 1-(3-methoxypyridin-4-yl)piperazine molecular structure lightbox
CAS RN: 151140-92-0

1-(3-methoxypyridin-4-yl)piperazine

  • Product code: SSC-061026
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 151140-92-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry

151140-92-0 / 1-(3-methoxy-4-pyridinyl)piperazine

Standard CAS: 151140-92-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
151140-92-0
Multi CAS
No
Molecular Formula
C10H15N3O
Molecular Weight
193.250000
Exact Mass
193.121512
SMILES
COC1=C(C=CN=C1)N2CCNCC2
InChI
InChI=1S/C10H15N3O/c1-14-10-8-12-3-2-9(10)13-6-4-11-5-7-13/h2-3,8,11H,4-7H2,1H3
InChIKey
KQPQNNCTSFGSCX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
55.87
TPSA
37.39

LogP / Solubility

WLOGP
0.5
MLOGP
0.44
XLogP3
0.3
Consensus LogP
0.41
Log S (ESOL)
-1.54
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
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)
-3.54

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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