CAS RN: 22504-72-9
N,N’-dimethylsulphamide
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.20250615 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS22504-72-9
- Purity/Analytical Methods: >99.0%
22504-72-9 / N-(methylsulfamoyl)methanamine
Basic Information
CAS
22504-72-9
Multi CAS
No
Molecular Formula
C2H8N2O2S
Molecular Weight
124.170000
Exact Mass
124.030649
SMILES
CNS(=O)(=O)NC
InChI
InChI=1S/C2H8N2O2S/c1-3-7(5,6)4-2/h3-4H,1-2H3
InChIKey
SQNVFBHILRFQJY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
27.04
TPSA
58.2
LogP / Solubility
WLOGP
-1.33
MLOGP
-1.18
XLogP3
-0.9
Consensus LogP
-1.14
Log S (ESOL)
0.36
Class (ESOL)
Highly soluble
Log S (Ali)
0.38
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.4
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)
-4.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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