[email protected]
CAS 5751-51-9 4H-1-Benzopyran-4-one, 7-Methyl- molecular structure lightbox
CAS RN: 5751-51-9

4H-1-Benzopyran-4-one, 7-Methyl-

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251221 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS5751-51-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

5751-51-9 / 7-methylchromen-4-one

Standard CAS: 5751-51-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
5751-51-9
Multi CAS
No
Molecular Formula
C10H8O2
Molecular Weight
160.170000
Exact Mass
160.052429
InChI
InChI=1S/C10H8O2/c1-7-2-3-8-9(11)4-5-12-10(8)6-7/h2-6H,1H3
InChIKey
MOISBGWJJHJRIH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
Fraction Csp3
0.1
H-bond acceptors
2
Molar refractivity
47.22
TPSA
30.21

LogP / Solubility

WLOGP
2.1
MLOGP
1.84
XLogP3
1.7
Consensus LogP
1.88
Log S (ESOL)
-2.77
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us