CAS RN: 73738-06-4
Primidone-D5
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20260317 |
1mg |
Out of stock |
8-10 business days | Inquiry |
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Product code:
starshine_CAS73738-06-4
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Purity/Analytical Methods:
>99.0%
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73738-06-4 / 5-(1,1,2,2,2-pentadeuterioethyl)-5-phenyl-1,3-diazinane-4,6-dione
Standard CAS: 73738-06-4
Multi CAS: Yes
Basic Information
CAS
73738-06-4
Multi CAS
Yes
Molecular Formula
C12H14N2O2
Molecular Weight
223.280000
Exact Mass
223.136911
InChI
InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)/i1D3,2D2
InChIKey
DQMZLTXERSFNPB-ZBJDZAJPSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
59.56
TPSA
58.2
LogP / Solubility
WLOGP
0.54
MLOGP
0.48
XLogP3
0.9
Consensus LogP
0.64
Log S (ESOL)
-1.68
Class (ESOL)
Soluble
Log S (Ali)
-1.74
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.77
Class (SILICOS-IT)
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)
-3.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5