![CAS 2055935-90-3 “(3aS,8aR)- 3a,8a-dihydro-2-(2-quinolinyl)-8H-Indeno[1,2-d]oxazole” molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2055935-90-3.png)
CAS RN: 2055935-90-3
“(3aS,8aR)- 3a,8a-dihydro-2-(2-quinolinyl)-8H-Indeno[1,2-d]oxazole”
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250113 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20251120 | 1g | In stock | Shenzhen, Tianjin, Chengdu | Inquiry | |
| Batchno.20260314 | 250mg | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20250522 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250920 | 5g | Out of stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251201 | 50mg / 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2055935-90-3
- Purity/Analytical Methods: >99.0%
2055935-90-3 / (3aR,8bS)-2-quinolin-2-yl-4,8b-dihydro-3aH-indeno[1,2-d][1,3]oxazole
Basic Information
CAS
2055935-90-3
Multi CAS
No
Molecular Formula
C19H14N2O
Molecular Weight
286.300000
Exact Mass
286.110613
SMILES
C1[C@@H]2[C@H](C3=CC=CC=C31)N=C(O2)C4=NC5=CC=CC=C5C=C4
InChI
InChI=1S/C19H14N2O/c1-3-7-14-13(6-1)11-17-18(14)21-19(22-17)16-10-9-12-5-2-4-8-15(12)20-16/h1-10,17-18H,11H2/t17-,18+/m1/s1
InChIKey
OYXOYKBPSDLDAZ-MSOLQXFVSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
16
Fraction Csp3
0.16
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
86.04
TPSA
34.48
LogP / Solubility
WLOGP
3.68
MLOGP
3.25
XLogP3
3.9
Consensus LogP
3.61
Log S (ESOL)
-4.4
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.56
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.69
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)
-1.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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