[email protected]
CAS 37055-19-9 1,1′-Biphenyl, 3,3′,5,5′-tetraiodo-2,2′,4,4′,6,6′-hexamethyl- molecular structure lightbox
CAS RN: 37055-19-9

1,1′-Biphenyl, 3,3′,5,5′-tetraiodo-2,2′,4,4′,6,6′-hexamethyl-

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250201 100mg In stock Shanghai Inquiry
Batchno.20250304 1g In stock Shanghai Inquiry
Batchno.20260623 250mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250419 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: LINB887177
GET A QUOTE

37055-19-9 / 1-(3,5-diiodo-2,4,6-trimethylphenyl)-3,5-diiodo-2,4,6-trimethylbenzene

Standard CAS: 37055-19-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
37055-19-9
Multi CAS
No
Molecular Formula
C18H18I4
Molecular Weight
742.000000
Exact Mass
741.758700
InChI
InChI=1S/C18H18I4/c1-7-13(8(2)16(20)11(5)15(7)19)14-9(3)17(21)12(6)18(22)10(14)4/h1-6H3
InChIKey
WRGDLXUOFLFEPU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
1
Molar refractivity
131.17
TPSA
0.0000

LogP / Solubility

WLOGP
7.62
MLOGP
6.77
XLogP3
8.3
Consensus LogP
7.56
Log S (ESOL)
-9.58
Class (ESOL)
Insoluble
Log S (Ali)
-11.15
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.93
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)
-1.83

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
2.5

Customers Also Viewed

Get In Touch

Contact Us