CAS RN: 62009-37-4
5-Bromo-N,N-diethylpyridine-3-sulphonamide
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.20260216 | 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS62009-37-4
- Purity/Analytical Methods: >99.0%
62009-37-4 / 5-bromo-N,N-diethylpyridine-3-sulfonamide
Basic Information
CAS
62009-37-4
Multi CAS
Yes
Molecular Formula
BC9H13O2Rn2S
Molecular Weight
293.180000
Exact Mass
291.988110
InChI
InChI=1S/C9H13BrN2O2S/c1-3-12(4-2)15(13,14)9-5-8(10)6-11-7-9/h5-7H,3-4H2,1-2H3
InChIKey
DMCLRSISAMTJLN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.44
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
62.04
TPSA
50.27
LogP / Solubility
WLOGP
1.87
MLOGP
1.66
XLogP3
1.4
Consensus LogP
1.64
Log S (ESOL)
-2.87
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.32
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.6
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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