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CAS 265321-06-0 5-amino-3,6-dihydro-2H-pyran-3-one molecular structure lightbox
CAS RN: 265321-06-0

5-amino-3,6-dihydro-2H-pyran-3-one

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250901 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS265321-06-0
  • Purity/Analytical Methods: >99.0%
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265321-06-0 / 3-amino-2H-pyran-5-one

Standard CAS: 265321-06-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
265321-06-0
Multi CAS
No
Molecular Formula
C5H7NO2
Molecular Weight
113.110000
Exact Mass
113.047678
InChI
InChI=1S/C5H7NO2/c6-4-1-5(7)3-8-2-4/h1H,2-3,6H2
InChIKey
KTMIXPVPMKXBQL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
28.1
TPSA
52.32

LogP / Solubility

WLOGP
-0.57
MLOGP
-0.51
XLogP3
-0.9
Consensus LogP
-0.66
Log S (ESOL)
-0.18
Class (ESOL)
Very soluble
Log S (Ali)
-0.07
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.08
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.82

Drug-likeness / Medicinal Chemistry

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

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