CAS RN: 51726-07-9
5-CHLORO-3-(4-CHLOROPHENYL)ISOXAZOLE
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.20260224 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS51726-07-9
- Purity/Analytical Methods: >99.0%
51726-07-9 / 5-chloro-3-(4-chlorophenyl)-1,2-oxazole
Basic Information
CAS
51726-07-9
Multi CAS
No
Molecular Formula
C9H5CL2NO
Molecular Weight
214.040000
Exact Mass
212.974819
InChI
InChI=1S/C9H5Cl2NO/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H
InChIKey
HMDNAOBMBZXCSM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
51.96
TPSA
26.03
LogP / Solubility
WLOGP
3.65
MLOGP
3.21
XLogP3
3.6
Consensus LogP
3.49
Log S (ESOL)
-4.03
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.95
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.2
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.44
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
5-CHLORO-3-(4-METHYLPHENYL)ISOXAZOLE
- CAS RN: 51726-08-0
- Product Code: starshine_CAS51726-08-0
- Purity/Analytical method: >99.0%
-
4-OXO-1,4-DIHYDROBENZO[H]QUINOLINE-3-CARBOXYLIC ACID
- CAS RN: 51726-83-1
- Product Code: starshine_CAS51726-83-1
- Purity/Analytical method: >99.0%
-
5,6-DIMETHYL-2-OXO-1,2-DIHYDRO-PYRIDINE-3-CARBOXYLIC ACID
- CAS RN: 51727-05-0
- Product Code: SSC-158674
-
5-Pyrimidinecarboxylicacid, 1,2,3,6-tetrahydro-1-methyl-2,6-dioxo-
- CAS RN: 51727-06-1
- Product Code: SSC-158675
-
-
![CAS 51726-83-1 4-OXO-1,4-DIHYDROBENZO[H]QUINOLINE-3-CARBOXYLIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/51726-83-1.gif)
