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CAS 367508-01-8 Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate molecular structure lightbox
CAS RN: 367508-01-8

Diphenyl (N-Methoxy-N-methylcarbamoylmethyl)phosphonate

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250819 1g In stock Inquiry
Batchno.20250702 1g Out of stock 8-10 business days Inquiry
Batchno.20250727 200mg In stock Shanghai Inquiry
Batchno.20250223 250mg In stock Inquiry
Batchno.20251203 5g Out of stock Inquiry
  • Product code: ICTD3709
  • Purity/Analytical Methods: >95.0%(GC)
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367508-01-8 / 2-diphenoxyphosphoryl-N-methoxy-N-methylacetamide

Standard CAS: 367508-01-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
367508-01-8
Multi CAS
Yes
Molecular Formula
C16H18NO5P
Molecular Weight
335.290000
Exact Mass
335.092260
InChI
InChI=1S/C16H18NO5P/c1-17(20-2)16(18)13-23(19,21-14-9-5-3-6-10-14)22-15-11-7-4-8-12-15/h3-12H,13H2,1-2H3
InChIKey
CFSFGLDTIDFDMT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.19
Rotatable bonds
7
H-bond acceptors
5
Molar refractivity
86.39
TPSA
65.07

LogP / Solubility

WLOGP
3.36
MLOGP
2.97
XLogP3
2.7
Consensus LogP
3.01
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.73
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.47
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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