![CAS 497172-36-8 2,6-bis[(4R,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-Pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/497172-36-8.gif)
CAS RN: 497172-36-8
2,6-bis[(4R,5S)-4,5-dihydro-4,5-diphenyl-2-oxazolyl]-Pyridine
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251028 | 100mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250927 | 10g | In stock | Shanghai | Inquiry |
| Batchno.20250914 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20250830 | 250mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20260131 | 50mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20260306 | 5g | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS497172-36-8
- Purity/Analytical Methods: >99.0%
497172-36-8 / (4R,5S)-2-[6-[(4R,5S)-4,5-diphenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]-4,5-diphenyl-4,5-dihydro-1,3-oxazole
Basic Information
CAS
497172-36-8
Multi CAS
Yes
Molecular Formula
C35H27N3O2
Molecular Weight
521.600000
Exact Mass
521.210327
InChI
InChI=1S/C35H27N3O2/c1-5-14-24(15-6-1)30-32(26-18-9-3-10-19-26)39-34(37-30)28-22-13-23-29(36-28)35-38-31(25-16-7-2-8-17-25)33(40-35)27-20-11-4-12-21-27/h1-23,30-33H/t30-,31-,32+,33+/m1/s1
InChIKey
SMYDLHVQRYQCDL-FYZVQMPESA-N
Computed Properties
Structural Parameters
Heavy atom count
40
Aromatic heavy atom count
30
Fraction Csp3
0.11
Rotatable bonds
6
H-bond acceptors
5
Molar refractivity
156.21
TPSA
56.07
LogP / Solubility
WLOGP
7.6
MLOGP
6.73
XLogP3
7
Consensus LogP
7.11
Log S (ESOL)
-8.02
Class (ESOL)
Insoluble
Log S (Ali)
-9.32
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.08
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.51
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
8
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