CAS RN: 1760-27-6
OROSELONE
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.20251017 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1760-27-6
- Purity/Analytical Methods: >99.0%
1760-27-6 / 8-prop-1-en-2-ylfuro[2,3-h]chromen-2-one
Basic Information
CAS
1760-27-6
Multi CAS
No
Molecular Formula
C14H10O3
Molecular Weight
226.230000
Exact Mass
226.062994
SMILES
CC(=C)C1=CC2=C(O1)C=CC3=C2OC(=O)C=C3
InChI
InChI=1S/C14H10O3/c1-8(2)12-7-10-11(16-12)5-3-9-4-6-13(15)17-14(9)10/h3-7H,1H2,2H3
InChIKey
FQCPXIJRWHRHIP-UHFFFAOYSA-N
Physical Properties
Melting Point
188 - 189 °C
Physical Description
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
13
Fraction Csp3
0.07
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
66.96
TPSA
43.35
LogP / Solubility
WLOGP
3.57
MLOGP
3.15
XLogP3
3.7
Consensus LogP
3.47
Log S (ESOL)
-3.99
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.99
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.22
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)
-1.56
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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