[email protected]
CAS 115619-00-6 1-ETHYL-4-(4-NITROPHENYL)PIPERAZINE molecular structure lightbox
CAS RN: 115619-00-6

1-ETHYL-4-(4-NITROPHENYL)PIPERAZINE

Product Availability

Choose a grade to view its available package options.

3 package records2 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250912 250mg / 1g / 5g / 25g Confirm by inquiry Shandong, Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260122 250mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251130 250mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-015386
GET A QUOTE
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: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 115619-00-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

115619-00-6 / 1-ethyl-4-(4-nitrophenyl)piperazine

1-ethyl-4-(4-nitrophenyl)piperazine | DTXSID10386281 | RefChem:230330

Standard CAS: 115619-00-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
115619-00-6
Multi CAS
No
Molecular Formula
C12H17N3O2
Molecular Weight
235.280000
Exact Mass
235.132077
SMILES
CCN1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C12H17N3O2/c1-2-13-7-9-14(10-8-13)11-3-5-12(6-4-11)15(16)17/h3-6H,2,7-10H2,1H3
InChIKey
XEWICNRVCQLKIG-UHFFFAOYSA-N
Synonyms
1-ethyl-4-(4-nitrophenyl)piperazine DTXSID10386281 RefChem:230330 DTXCID00337303 Piperazine, 1-ethyl-4-(4-nitrophenyl)-

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
67.42
TPSA
49.62

LogP / Solubility

WLOGP
1.74
MLOGP
1.53
XLogP3
2.1
Consensus LogP
1.79
Log S (ESOL)
-2.46
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.74
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.99
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)
-2.92

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

Customers Also Viewed

Get In Touch

Contact Us