CAS RN: 2634687-69-5
(S)-4-(tert-Butyl)-2-(1,8-naphthyridin-2-yl)-4,5-dihydrooxazole
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260602 | 100mg | In stock | Shenzhen | Inquiry | |
| Batchno.20251111 | 1g | In stock | Tianjin | Inquiry | |
| Batchno.20251230 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250808 | 25mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20250723 | 25mg / 50mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250117 | 50mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: starshine_CAS2634687-69-5
- Purity/Analytical Methods: >99.0%
2634687-69-5 / (4S)-4-tert-butyl-2-(1,8-naphthyridin-2-yl)-4,5-dihydro-1,3-oxazole
Basic Information
CAS
2634687-69-5
Multi CAS
No
Molecular Formula
C15H17N3O
Molecular Weight
255.310000
Exact Mass
255.137162
SMILES
CC(C)(C)[C@H]1COC(=N1)C2=NC3=C(C=CC=N3)C=C2
InChI
InChI=1S/C15H17N3O/c1-15(2,3)12-9-19-14(18-12)11-7-6-10-5-4-8-16-13(10)17-11/h4-8,12H,9H2,1-3H3/t12-/m1/s1
InChIKey
JVJLNFRXYYATTD-GFCCVEGCSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
10
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
75.27
TPSA
47.37
LogP / Solubility
WLOGP
2.82
MLOGP
2.49
XLogP3
3.1
Consensus LogP
2.8
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.69
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.78
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.27
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
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