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CAS 124083-20-1 R-(+)-ETOMOXIR molecular structure lightbox
CAS RN: 124083-20-1

R-(+)-ETOMOXIR

Product Availability

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250713 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260511 1g Out of stock Inquiry
Batchno.20250823 250mg In stock Shanghai Inquiry
Batchno.20251119 25mg In stock Shanghai Inquiry
Batchno.20251227 50mg In stock Shanghai Inquiry
Batchno.20250117 5mg / 10mg / 25mg / 100mg / 500mg Confirm by inquiry Shanghai, Guangdong, Hebei Inquiry
  • Product code: starshine_CAS124083-20-1
  • Purity/Analytical Methods: >99.0%
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124083-20-1 / ethyl (2R)-2-[6-(4-chlorophenoxy)hexyl]oxirane-2-carboxylate

Standard CAS: 124083-20-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
124083-20-1
Multi CAS
No
Molecular Formula
C17H23ClO4
Molecular Weight
326.800000
Exact Mass
326.128487
SMILES
CCOC(=O)[C@]1(CO1)CCCCCCOC2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H23ClO4/c1-2-20-16(19)17(13-22-17)11-5-3-4-6-12-21-15-9-7-14(18)8-10-15/h7-10H,2-6,11-13H2,1H3/t17-/m1/s1
InChIKey
DZLOHEOHWICNIL-QGZVFWFLSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.59
Rotatable bonds
10
H-bond acceptors
4
Molar refractivity
85.35
TPSA
48.06

LogP / Solubility

WLOGP
4
MLOGP
3.54
XLogP3
4.3
Consensus LogP
3.95
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.13
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.31
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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