CAS RN: 38275-45-5
2-(Methylsulfonyl)-5-methylpyrimidine
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260530 | 100mg / 250mg / 500mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS38275-45-5
- Purity/Analytical Methods: >99.0%
38275-45-5 / 5-methyl-2-methylsulfonylpyrimidine
Basic Information
CAS
38275-45-5
Multi CAS
No
Molecular Formula
C6H8N2O2S
Molecular Weight
172.210000
Exact Mass
172.030649
InChI
InChI=1S/C6H8N2O2S/c1-5-3-7-6(8-4-5)11(2,9)10/h3-4H,1-2H3
InChIKey
VKXMPLKKSLHNQY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
39.88
TPSA
59.92
LogP / Solubility
WLOGP
0.19
MLOGP
0.16
XLogP3
0.1
Consensus LogP
0.15
Log S (ESOL)
-1.36
Class (ESOL)
Soluble
Log S (Ali)
-1.11
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.06
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)
-3.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
2-(Methylsulfonyl)pyriMidine-5-carbonitrile
- CAS RN: 38275-50-2
- Product Code: starshine_CAS38275-50-2
- Purity/Analytical method: >99.0%
-
-
-
