CAS RN: 614-26-6
44DICHLOROAZOXYBENZENE
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.20250718 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS614-26-6
- Purity/Analytical Methods: >99.0%
614-26-6 / (4-chlorophenyl)-(4-chlorophenyl)imino-oxidoazanium
Basic Information
CAS
614-26-6
Multi CAS
No
Molecular Formula
C12H8CL2N2O
Molecular Weight
267.110000
Exact Mass
266.001368
InChI
InChI=1S/C12H8Cl2N2O/c13-9-1-5-11(6-2-9)15-16(17)12-7-3-10(14)4-8-12/h1-8H
InChIKey
NMAZIJPSESMWSA-UHFFFAOYSA-N
Physical Properties
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
68.28
TPSA
38.43
LogP / Solubility
WLOGP
4.92
MLOGP
4.34
XLogP3
4.4
Consensus LogP
4.55
Log S (ESOL)
-4.99
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.72
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
N-Benzoyl-benzamide
- CAS RN: 614-28-8
- Product Code: starshine_CAS614-28-8
- Purity/Analytical method: >99.0%
-
1,2-diphenylethanol
- CAS RN: 614-29-9
- Product Code: starshine_CAS614-29-9
- Purity/Analytical method: >99.0%
-
-
-
