CAS RN: 547-44-4
SULFANILYLUREA
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.20251204 | 100mg | In stock | Shanghai, Shandong | Inquiry |
- Product code: starshine_CAS547-44-4
- Purity/Analytical Methods: >99.0%
547-44-4 / (4-aminophenyl)sulfonylurea
Basic Information
CAS
547-44-4
Multi CAS
No
Molecular Formula
C7H9N3O3S
Molecular Weight
215.230000
Exact Mass
215.036462
InChI
InChI=1S/C7H9N3O3S/c8-5-1-3-6(4-2-5)14(12,13)10-7(9)11/h1-4H,8H2,(H3,9,10,11)
InChIKey
WVAKABMNNSMCDK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
3
Molar refractivity
50.76
TPSA
115.28
LogP / Solubility
WLOGP
-0.37
MLOGP
-0.33
XLogP3
-1.5
Consensus LogP
-0.73
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.05
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.99
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
High
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)
-4.3
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
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