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CAS 67746-43-4 DIBENZYL DIETHYLPHOSPHORAMIDITE molecular structure lightbox
CAS RN: 67746-43-4

DIBENZYL DIETHYLPHOSPHORAMIDITE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260625 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS67746-43-4
  • Purity/Analytical Methods: >99.0%
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67746-43-4 / N-bis(phenylmethoxy)phosphanyl-N-ethylethanamine

Standard CAS: 67746-43-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67746-43-4
Multi CAS
No
Molecular Formula
C18H24NO2P
Molecular Weight
317.400000
Exact Mass
317.154466
InChI
InChI=1S/C18H24NO2P/c1-3-19(4-2)22(20-15-17-11-7-5-8-12-17)21-16-18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKey
NLGUJOVLAXLSMX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
9
H-bond acceptors
3
Molar refractivity
92.3
TPSA
21.7

LogP / Solubility

WLOGP
4.99
MLOGP
4.4
XLogP3
4
Consensus LogP
4.46
Log S (ESOL)
-4.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.76
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.94
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.11

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
2.5

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