![CAS 2757082-89-4 Pyridine, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-4-methoxy-6-methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2757082-89-4.gif)
CAS RN: 2757082-89-4
Pyridine, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-4-methoxy-6-methyl-
Product Availability
Choose a grade to view its available package options.
2 package records1 with current stock1 grade group
- Product code: SSC-127239
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
2757082-89-4 / (4R)-2-(4-methoxy-6-methyl-2-pyridinyl)-4-phenyl-4,5-dihydro-1,3-oxazole
Basic Information
CAS
2757082-89-4
Multi CAS
Yes
Molecular Formula
C16H16N2O2
Molecular Weight
268.310000
Exact Mass
268.121178
InChI
InChI=1S/C16H16N2O2/c1-11-8-13(19-2)9-14(17-11)16-18-15(10-20-16)12-6-4-3-5-7-12/h3-9,15H,10H2,1-2H3/t15-/m0/s1
InChIKey
JSWIPBMQZNDWNW-HNNXBMFYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
77.2
TPSA
43.71
LogP / Solubility
WLOGP
2.92
MLOGP
2.57
XLogP3
2.8
Consensus LogP
2.76
Log S (ESOL)
-3.59
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.18
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
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