CAS RN: 72943-90-9

5,6,7,4′-Tetramethoxyflavanone

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Batchno.20250718 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS72943-90-9
  • Purity/Analytical Methods: >99.0%
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72943-90-9 / 5,6,7-trimethoxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one

Standard CAS: 72943-90-9 Multi CAS: Yes

Basic Information

CAS
72943-90-9
Multi CAS
Yes
Molecular Formula
C19H20O6
Molecular Weight
344.400000
Exact Mass
344.125988
InChI
InChI=1S/C19H20O6/c1-21-12-7-5-11(6-8-12)14-9-13(20)17-15(25-14)10-16(22-2)18(23-3)19(17)24-4/h5-8,10,14H,9H2,1-4H3
InChIKey
AENXIAWIJGWYCP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
12
Fraction Csp3
0.32
Rotatable bonds
5
H-bond acceptors
6
Molar refractivity
91.41
TPSA
63.22

LogP / Solubility

WLOGP
3.43
MLOGP
3.03
XLogP3
2.8
Consensus LogP
3.09
Log S (ESOL)
-4.16
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.86
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.34
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.39

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

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