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CAS 92134-98-0 Fosphenytoin sodium molecular structure lightbox
CAS RN: 92134-98-0

Fosphenytoin sodium

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260415 100mg In stock Inquiry
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  • Product code: starshine_CAS92134-98-0
  • Purity/Analytical Methods: >99.0%
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92134-98-0 / disodium;(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl phosphate

Standard CAS: 92134-98-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
92134-98-0
Multi CAS
Yes
Molecular Formula
C16H13N2NA2O6P
Molecular Weight
406.240000
Exact Mass
406.030662
InChI
InChI=1S/C16H15N2O6P.2Na/c19-14-16(12-7-3-1-4-8-12,13-9-5-2-6-10-13)17-15(20)18(14)11-24-25(21,22)23;;/h1-10H,11H2,(H,17,20)(H2,21,22,23);;/q;2*+1/p-2
InChIKey
GQPXYJNXTAFDLT-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.12
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
1
Molar refractivity
82.6
TPSA
121.83

LogP / Solubility

WLOGP
-5.71
MLOGP
-5
XLogP3
-5.71
Consensus LogP
-5.47
Log S (ESOL)
1.24
Class (ESOL)
Highly soluble
Log S (Ali)
1.23
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.84
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-9.25

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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