![CAS 143165-32-6 3-(1,4-DIOXASPIRO[4.5]DEC-7-EN-8-YL)-1H-INDOLE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB7410134.gif)
CAS RN: 143165-32-6
3-(1,4-DIOXASPIRO[4.5]DEC-7-EN-8-YL)-1H-INDOLE
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.20250313 | 10mg / 50mg / 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS143165-32-6
- Purity/Analytical Methods: >99.0%
143165-32-6 / 3-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)-1H-indole
Basic Information
CAS
143165-32-6
Multi CAS
No
Molecular Formula
C16H17NO2
Molecular Weight
255.310000
Exact Mass
255.125929
SMILES
C1CC2(CC=C1C3=CNC4=CC=CC=C43)OCCO2
InChI
InChI=1S/C16H17NO2/c1-2-4-15-13(3-1)14(11-17-15)12-5-7-16(8-6-12)18-9-10-19-16/h1-5,11,17H,6-10H2
InChIKey
BOSKLOMTRITQHA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
9
Fraction Csp3
0.38
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
74.76
TPSA
34.25
LogP / Solubility
WLOGP
3.48
MLOGP
3.07
XLogP3
2.5
Consensus LogP
3.02
Log S (ESOL)
-3.9
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.33
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.81
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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