CAS RN: 31876-74-1
Tris(1,10-phenanthroline)cobalt(II) Bis(hexafluorophosphate)
Product Availability
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5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
| Batchno.20250115 |
10g |
In stock |
Shanghai | Inquiry |
| Batchno.20250419 |
1g |
In stock |
Shanghai | Inquiry |
| Batchno.20260515 |
250mg |
In stock |
Shanghai | Inquiry |
| Batchno.20251210 |
250mg / 1g / 5g |
Confirm by inquiry |
Shanghai | Inquiry |
| Batchno.20260218 |
5g |
In stock |
Shanghai | Inquiry |
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Product code:
ICTT3553
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Purity/Analytical Methods:
>98.0%(T)(HPLC)
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31876-74-1 / cobalt(2+);tris(1,10-phenanthroline);dihexafluorophosphate
Standard CAS: 31876-74-1
Multi CAS: No
Basic Information
CAS
31876-74-1
Multi CAS
No
Molecular Formula
C37F12H24N6OP2
Molecular Weight
889.500000
Exact Mass
889.067800
InChI
InChI=1S/3C12H8N2.Co.2F6P/c3*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;2*1-7(2,3,4,5)6/h3*1-8H;;;/q;;;+2;2*-1
InChIKey
XOLDWYRTFCWAIM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
57
Aromatic heavy atom count
42
H-bond acceptors
6
Molar refractivity
198.27
TPSA
77.34
LogP / Solubility
WLOGP
15.11
MLOGP
13.38
XLogP3
15.11
Consensus LogP
14.53
Log S (ESOL)
-15.42
Class (ESOL)
Insoluble
Log S (Ali)
-17.76
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.98
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
2.58
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
7