CAS RN: 63119-27-7
anitrazafen
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251029 | 5mg / 10mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS63119-27-7
- Purity/Analytical Methods: >99.0%
63119-27-7 / 5,6-bis(4-methoxyphenyl)-3-methyl-1,2,4-triazine
Basic Information
CAS
63119-27-7
Multi CAS
No
Molecular Formula
C18H17N3O2
Molecular Weight
307.300000
Exact Mass
307.132077
InChI
InChI=1S/C18H17N3O2/c1-12-19-17(13-4-8-15(22-2)9-5-13)18(21-20-12)14-6-10-16(23-3)11-7-14/h4-11H,1-3H3
InChIKey
HDNJXZZJFPCFHG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
18
Fraction Csp3
0.17
Rotatable bonds
4
H-bond acceptors
5
Molar refractivity
88.54
TPSA
57.13
LogP / Solubility
WLOGP
3.53
MLOGP
3.12
XLogP3
2.9
Consensus LogP
3.18
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.63
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.07
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.09
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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