CAS RN: 5188-73-8
axillarin
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.20250814 | 5mg | Out of stock | 30 business days | Inquiry |
- Product code: starshine_CAS5188-73-8
- Purity/Analytical Methods: >99.0%
5188-73-8 / 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-dimethoxychromen-4-one
Basic Information
CAS
5188-73-8
Multi CAS
No
Molecular Formula
C17H14O8
Molecular Weight
346.300000
Exact Mass
346.068867
InChI
InChI=1S/C17H14O8/c1-23-16-10(20)6-11-12(13(16)21)14(22)17(24-2)15(25-11)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3
InChIKey
KIGVXRGRNLQNNI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
16
Fraction Csp3
0.12
Rotatable bonds
3
H-bond acceptors
8
H-bond donors
4
Molar refractivity
87.68
TPSA
129.59
LogP / Solubility
WLOGP
2.3
MLOGP
2.04
XLogP3
2.5
Consensus LogP
2.28
Log S (ESOL)
-3.71
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.06
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.18
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
-
-
L-Ornithine 2-oxoglutarate
- CAS RN: 5191-97-9
- Product Code: starshine_CAS5191-97-9
- Purity/Analytical method: >99.0%
-
4,6-Dihydroxy-5-methoxypyrimidine
- CAS RN: 5193-84-0
- Product Code: starshine_CAS5193-84-0
- Purity/Analytical method: >99.0%
-
