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CAS 1229012-68-3 2,9-Dichloro-4,7-diphenyl-1,10-phenanthroline molecular structure lightbox
CAS RN: 1229012-68-3

2,9-Dichloro-4,7-diphenyl-1,10-phenanthroline

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260415 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250802 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260525 10g In stock Shanghai Inquiry
Batchno.20250723 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250607 250mg In stock Shanghai Inquiry
Batchno.20250505 5g In stock Shanghai, Wuhan Inquiry
  • Product code: SSC-026597
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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: 0.25g, 0.1g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 2
  • 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 1229012-68-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 3 In Stock Beijing Inquiry
0.1g ≥95% 1 In Stock Shenzhen Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1229012-68-3 / 2,9-dichloro-4,7-diphenyl-1,10-phenanthroline

Standard CAS: 1229012-68-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1229012-68-3
Multi CAS
No
Molecular Formula
C24H14Cl2N2
Molecular Weight
401.300000
Exact Mass
400.053404
SMILES
C1=CC=C(C=C1)C2=CC(=NC3=C2C=CC4=C3N=C(C=C4C5=CC=CC=C5)Cl)Cl
InChI
InChI=1S/C24H14Cl2N2/c25-21-13-19(15-7-3-1-4-8-15)17-11-12-18-20(16-9-5-2-6-10-16)14-22(26)28-24(18)23(17)27-21/h1-14H
InChIKey
ILQFTFBKMWFBPG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
26
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
117.94
TPSA
25.78

LogP / Solubility

WLOGP
7.42
MLOGP
6.56
XLogP3
7.6
Consensus LogP
7.19
Log S (ESOL)
-7.56
Class (ESOL)
Insoluble
Log S (Ali)
-8.21
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.67
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.1

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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