CAS RN: 1197-23-5
N-2-Pyridinylmethanesulfonamide
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.20250119 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1197-23-5
- Purity/Analytical Methods: >99.0%
1197-23-5 / N-pyridin-2-ylmethanesulfonamide
N-(pyridin-2-yl)methanesulfonamide | DTXSID70385311 | RefChem:362894
Basic Information
CAS
1197-23-5
Multi CAS
No
Molecular Formula
C6H8N2O2S
Molecular Weight
172.210000
Exact Mass
172.030649
SMILES
CS(=O)(=O)NC1=CC=CC=N1
InChI
InChI=1S/C6H8N2O2S/c1-11(9,10)8-6-4-2-3-5-7-6/h2-5H,1H3,(H,7,8)
InChIKey
VWJMXGHSQCIPPX-UHFFFAOYSA-N
Synonyms
N-(pyridin-2-yl)methanesulfonamide
DTXSID70385311
RefChem:362894
DTXCID80336334
N-pyridin-2-ylmethanesulfonamide
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
42.7
TPSA
59.06
LogP / Solubility
WLOGP
0.45
MLOGP
0.4
XLogP3
-0.9
Consensus LogP
-0.02
Log S (ESOL)
-1.46
Class (ESOL)
Soluble
Log S (Ali)
-1.3
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.4
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)
-3.45
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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