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CAS 6269-89-2 1-(4-Nitrophenyl)piperazine molecular structure lightbox
CAS RN: 6269-89-2

1-(4-Nitrophenyl)piperazine

  • Product code: SSC-171955
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 10g, 25g, 100g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 6269-89-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥95% 5 In Stock Shenzhen Inquiry
25g ≥95% 4 In Stock Shenzhen Inquiry
100g ≥95% 4 In Stock Shanghai Inquiry
5g ≥95% 1 In Stock Shenzhen Inquiry

6269-89-2 / 1-(4-nitrophenyl)piperazine

Standard CAS: 6269-89-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6269-89-2
Multi CAS
Yes
Molecular Formula
C10H13N3O2
Molecular Weight
207.230000
Exact Mass
207.100777
InChI
InChI=1S/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H2
InChIKey
VWOJSRICSKDKAW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
58.18
TPSA
58.41

LogP / Solubility

WLOGP
1
MLOGP
0.88
XLogP3
1
Consensus LogP
0.96
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-1.98
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.08
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)
-3.27

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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