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CAS 22384-53-8 5-Butyloxazolidine-2,4-dione molecular structure lightbox
CAS RN: 22384-53-8

5-Butyloxazolidine-2,4-dione

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250606 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS22384-53-8
  • Purity/Analytical Methods: >99.0%
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22384-53-8 / 5-butyl-1,3-oxazolidine-2,4-dione

Standard CAS: 22384-53-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22384-53-8
Multi CAS
No
Molecular Formula
C7H11NO3
Molecular Weight
157.170000
Exact Mass
157.073893
SMILES
CCCCC1C(=O)NC(=O)O1
InChI
InChI=1S/C7H11NO3/c1-2-3-4-5-6(9)8-7(10)11-5/h5H,2-4H2,1H3,(H,8,9,10)
InChIKey
ZCXUOKHTQOCCRV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.71
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
37.94
TPSA
55.4

LogP / Solubility

WLOGP
0.81
MLOGP
0.71
XLogP3
1.4
Consensus LogP
0.97
Log S (ESOL)
-1.13
Class (ESOL)
Soluble
Log S (Ali)
-1.43
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.72
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.1

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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