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CAS 38260-54-7 Etrimfos solution, 100μg/mL,u=2% in acetone molecular structure lightbox
CAS RN: 38260-54-7

Etrimfos solution, 100μg/mL,u=2% in acetone

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260121 1ml Out of stock 8-10 business days Inquiry
  • Product code: LINE809152
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38260-54-7 / (6-ethoxy-2-ethylpyrimidin-4-yl)oxy-dimethoxy-sulfanylidene-lambda5-phosphane

Standard CAS: 38260-54-7 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
38260-54-7
Multi CAS
No
Molecular Formula
C10H17N2O4PS
Molecular Weight
292.290000
Exact Mass
292.064665
InChI
InChI=1S/C10H17N2O4PS/c1-5-8-11-9(15-6-2)7-10(12-8)16-17(18,13-3)14-4/h7H,5-6H2,1-4H3
InChIKey
FGIWFCGDPUIBEZ-UHFFFAOYSA-N

Physical Properties

Melting Point
-3.35 °C
Density
1.195 at 20 °C
Physical Description
Colorless liquid; [Merck Index] Liquid
Appearance
Colorless oil
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
7
H-bond acceptors
7
Molar refractivity
71.51
TPSA
62.7

LogP / Solubility

WLOGP
2.33
MLOGP
2.06
XLogP3
3.2
Consensus LogP
2.53
Log S (ESOL)
-2.91
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.64
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.34
Class (SILICOS-IT)
Slightly 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)
-2.85

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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