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CAS 185110-06-9 2-(3,4-DICHLORO-PHENYL)-PIPERAZINE molecular structure lightbox
CAS RN: 185110-06-9

2-(3,4-DICHLORO-PHENYL)-PIPERAZINE

  • Product code: SSC-085637
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 7
  • 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 185110-06-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 5 In Stock Beijing Inquiry
0.25g -- 5 In Stock Hong Kong Inquiry
1g >95% 4 In Stock Beijing Inquiry
1g -- 3 In Stock Shenzhen Inquiry
0.1g >95% 1 In Stock Shanghai Inquiry
5g -- 1 In Stock Shenzhen Inquiry
5g >95% 1 In Stock Hong Kong Inquiry
0.25g >95% 0 Out of Stock Shenzhen Inquiry

185110-06-9 / 2-(3,4-dichlorophenyl)piperazine

Standard CAS: 185110-06-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
185110-06-9
Multi CAS
No
Molecular Formula
C10H12Cl2N2
Molecular Weight
231.120000
Exact Mass
230.037754
SMILES
C1CNC(CN1)C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C10H12Cl2N2/c11-8-2-1-7(5-9(8)12)10-6-13-3-4-14-10/h1-2,5,10,13-14H,3-4,6H2
InChIKey
PUJZPGUYDJGSAC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
60.08
TPSA
24.06

LogP / Solubility

WLOGP
2.23
MLOGP
1.96
XLogP3
1.9
Consensus LogP
2.03
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.06
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.13
Class (SILICOS-IT)
Poorly 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)
-2.55

Drug-likeness / Medicinal Chemistry

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

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