![CAS 2770294-30-7 2,2′-(propane-2,2-diyl)bis(5-methoxybenzo[d]oxazole) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2770294-30-7.gif)
CAS RN: 2770294-30-7
2,2′-(propane-2,2-diyl)bis(5-methoxybenzo[d]oxazole)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260124 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS2770294-30-7
- Purity/Analytical Methods: >99.0%
2770294-30-7 / 5-methoxy-2-[2-(5-methoxy-1,3-benzoxazol-2-yl)propan-2-yl]-1,3-benzoxazole
Basic Information
CAS
2770294-30-7
Multi CAS
No
Molecular Formula
C19H18N2O4
Molecular Weight
338.400000
Exact Mass
338.126657
SMILES
CC(C)(C1=NC2=C(O1)C=CC(=C2)OC)C3=NC4=C(O3)C=CC(=C4)OC
InChI
InChI=1S/C19H18N2O4/c1-19(2,17-20-13-9-11(22-3)5-7-15(13)24-17)18-21-14-10-12(23-4)6-8-16(14)25-18/h5-10H,1-4H3
InChIKey
NGWDBUWTKIEOJB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
18
Fraction Csp3
0.26
Rotatable bonds
4
H-bond acceptors
6
Molar refractivity
93.25
TPSA
70.52
LogP / Solubility
WLOGP
4.31
MLOGP
3.81
XLogP3
4.4
Consensus LogP
4.17
Log S (ESOL)
-4.92
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.45
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.92
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.72
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 2791277-41-1 1,3,2-Dioxaborolane, 2-[7-fluoro-8-[2-[tris(1-methylethyl)sily/]ethynyI]-3-[[tris(1-methylethyl)silyI]oxy]-1-naphthalenyI]-4,4,5,5-tetramethyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2791277-41-1.gif)
![CAS 2803456-23-5 2,2′,2”,2”’,2””,2””’,2”””,2”””’-((Ethene-1,1,2,2-tetrayltetrakis(benzene-4,1-diyl))tetrakis([1,1′:3′,1”-terphenyl]-5′,4,4”-triyl))octaacetonitrile molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2803456-23-5.gif)
