CAS RN: 2244249-07-6
Dibenzofuran, 1-chloro-6-phenyl-
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260129 | 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2244249-07-6
- Purity/Analytical Methods: >99.0%
2244249-07-6 / 1-chloro-6-phenyldibenzofuran
Basic Information
CAS
2244249-07-6
Multi CAS
No
Molecular Formula
C18H11ClO
Molecular Weight
278.700000
Exact Mass
278.049843
SMILES
C1=CC=C(C=C1)C2=CC=CC3=C2OC4=C3C(=CC=C4)Cl
InChI
InChI=1S/C18H11ClO/c19-15-10-5-11-16-17(15)14-9-4-8-13(18(14)20-16)12-6-2-1-3-7-12/h1-11H
InChIKey
UBYYBQQLRRFNBN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
19
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
84.17
TPSA
13.14
LogP / Solubility
WLOGP
5.91
MLOGP
5.21
XLogP3
5.9
Consensus LogP
5.67
Log S (ESOL)
-5.93
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.11
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.49
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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