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CAS 209971-43-7 N-(5-IODO-PYRIDIN-2-YL)-4-METHYL-BENZENESULFONAMIDE molecular structure lightbox
CAS RN: 209971-43-7

N-(5-IODO-PYRIDIN-2-YL)-4-METHYL-BENZENESULFONAMIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250420 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-099840
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 209971-43-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

209971-43-7 / N-(5-iodo-2-pyridinyl)-4-methylbenzenesulfonamide

Standard CAS: 209971-43-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
209971-43-7
Multi CAS
No
Molecular Formula
C12H11IN2O2S
Molecular Weight
374.200000
Exact Mass
373.958600
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(C=C2)I
InChI
InChI=1S/C12H11IN2O2S/c1-9-2-5-11(6-3-9)18(16,17)15-12-7-4-10(13)8-14-12/h2-8H,1H3,(H,14,15)
InChIKey
FSQZWFRWAZIXCK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
78.94
TPSA
59.06

LogP / Solubility

WLOGP
2.8
MLOGP
2.48
XLogP3
2.7
Consensus LogP
2.66
Log S (ESOL)
-4.22
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.65
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.77
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.02

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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