![CAS 1027754-32-0 6,8-Methanoquinoline, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-5,6,7,8-tetrahydro-7,7-dimethyl-, (6R,8R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1027754-32-0.gif)
CAS RN: 1027754-32-0
6,8-Methanoquinoline, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-5,6,7,8-tetrahydro-7,7-dimethyl-, (6R,8R)-
Product Availability
Choose a grade to view its available package options.
6 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260107 | 100mg | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260105 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250411 | 1g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260402 | 250mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250423 | 50mg | Out of stock | Inquiry | ||
| Batchno.20260502 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS1027754-32-0
- Purity/Analytical Methods: >99.0%
1027754-32-0 / (4R)-2-[(1R,9R)-10,10-dimethyl-3-azatricyclo[7.1.1.02,7]undeca-2(7),3,5-trien-4-yl]-4-phenyl-4,5-dihydro-1,3-oxazole
(S)-2-((6R,8R)-7,7-Dimethyl-5,6,7,8-tetrahydro-6,8-methanoquinolin-2-yl)-4-phenyl-4,5-dihydrooxazole | (4S)-2-[(1R,9R)-10,10-dimethyl-3-azatricyclo[7.1.1.02,7]undeca-2(7),3,5-trien-4-yl]-4-phenyl-4,5-dihydro-1,3-oxazole | (S)-2-[(6R,8R)-7,7-Dimethyl-5,6,7,8-tetrahydro-6,8-methanoquinolin-2-yl]-4-phenyl-4,5-dihydrooxazole
Basic Information
CAS
1027754-32-0
Multi CAS
Yes
Molecular Formula
C21H22N2O
Molecular Weight
318.400000
Exact Mass
318.173213
SMILES
CC1([C@@H]2C[C@H]1C3=C(C2)C=CC(=N3)C4=N[C@@H](CO4)C5=CC=CC=C5)C
InChI
InChI=1S/C21H22N2O/c1-21(2)15-10-14-8-9-17(22-19(14)16(21)11-15)20-23-18(12-24-20)13-6-4-3-5-7-13/h3-9,15-16,18H,10-12H2,1-2H3/t15-,16-,18-/m0/s1
InChIKey
BQPOTNVOGYBVEV-BQFCYCMXSA-N
Synonyms
(S)-2-((6R,8R)-7,7-Dimethyl-5,6,7,8-tetrahydro-6,8-methanoquinolin-2-yl)-4-phenyl-4,5-dihydrooxazole
(4S)-2-[(1R,9R)-10,10-dimethyl-3-azatricyclo[7.1.1.02,7]undeca-2(7),3,5-trien-4-yl]-4-phenyl-4,5-dihydro-1,3-oxazole
(S)-2-[(6R,8R)-7,7-Dimethyl-5,6,7,8-tetrahydro-6,8-methanoquinolin-2-yl]-4-phenyl-4,5-dihydrooxazole
MFCD34563831
BS-51748
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
94.24
TPSA
34.48
LogP / Solubility
WLOGP
4.29
MLOGP
3.79
XLogP3
4.1
Consensus LogP
4.06
Log S (ESOL)
-4.75
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.27
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.53
Class (SILICOS-IT)
Slightly soluble
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
No
Log Kp (skin permeation)
-1.62
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
7.5
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