![CAS 396094-85-2 Oxazole, 4,5-dihydro-2-[2-[(R)-(4-methylphenyl)sulfinyl]phenyl]-4-phenyl-, (4S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/396094-85-2.gif)
CAS RN: 396094-85-2
Oxazole, 4,5-dihydro-2-[2-[(R)-(4-methylphenyl)sulfinyl]phenyl]-4-phenyl-, (4S)-
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250324 | 100mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry | |
| Batchno.20250720 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20251227 | 1g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260617 | 250mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250803 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS396094-85-2
- Purity/Analytical Methods: >99.0%
396094-85-2 / (4S)-2-[2-(4-methylphenyl)sulfinylphenyl]-4-phenyl-4,5-dihydro-1,3-oxazole
Basic Information
CAS
396094-85-2
Multi CAS
Yes
Molecular Formula
C22H19NO2S
Molecular Weight
361.500000
Exact Mass
361.113650
InChI
InChI=1S/C22H19NO2S/c1-16-11-13-18(14-12-16)26(24)21-10-6-5-9-19(21)22-23-20(15-25-22)17-7-3-2-4-8-17/h2-14,20H,15H2,1H3/t20-,26?/m1/s1
InChIKey
DAFPBDIGMMUDMU-TUHVGIAZSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
18
Fraction Csp3
0.14
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
103.97
TPSA
38.66
LogP / Solubility
WLOGP
4.68
MLOGP
4.14
XLogP3
4.3
Consensus LogP
4.37
Log S (ESOL)
-5.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.9
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.37
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.6
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
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