CAS RN: 1065102-51-3
2-(4-Chlorophenyl)-4-oxazolecarboxylic acid
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.20251012 | 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-008149
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 0.1g, 0.25g, 5g
- Available purity: ≥95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
1065102-51-3 / 2-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid
2-(4-Chlorophenyl)oxazole-4-carboxylic Acid | 2-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid | MFCD16698588
Basic Information
CAS
1065102-51-3
Multi CAS
Yes
Molecular Formula
C10H6ClNO3
Molecular Weight
223.610000
Exact Mass
223.003621
SMILES
C1=CC(=CC=C1C2=NC(=CO2)C(=O)O)Cl
InChI
InChI=1S/C10H6ClNO3/c11-7-3-1-6(2-4-7)9-12-8(5-15-9)10(13)14/h1-5H,(H,13,14)
InChIKey
AUTVMMYIVCLSMR-UHFFFAOYSA-N
Synonyms
2-(4-Chlorophenyl)oxazole-4-carboxylic Acid
2-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid
MFCD16698588
2-(4-Chlorophenyl)-4-oxazolecarboxylic acid
2-(4-Chlorophenyl)oxazole-4-carboxylicAcid
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
11
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.91
TPSA
63.33
LogP / Solubility
WLOGP
2.69
MLOGP
2.37
XLogP3
2.5
Consensus LogP
2.52
Log S (ESOL)
-3.33
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.34
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.59
Class (SILICOS-IT)
Poorly 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)
-2.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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