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CAS 327975-71-3 5-AMINO-2-METHOXY-N-(4-METHOXY-PHENYL)-BENZENESULFONAMIDE molecular structure lightbox
CAS RN: 327975-71-3

5-AMINO-2-METHOXY-N-(4-METHOXY-PHENYL)-BENZENESULFONAMIDE

  • Product code: SSC-138486
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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: 0.25g
  • 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 327975-71-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

327975-71-3 / 5-amino-2-methoxy-N-(4-methoxyphenyl)benzenesulfonamide

Standard CAS: 327975-71-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
327975-71-3
Multi CAS
No
Molecular Formula
C14H16N2O4S
Molecular Weight
308.350000
Exact Mass
308.083078
InChI
InChI=1S/C14H16N2O4S/c1-19-12-6-4-11(5-7-12)16-21(17,18)14-9-10(15)3-8-13(14)20-2/h3-9,16H,15H2,1-2H3
InChIKey
AMDPAIQVKSGCKJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
81.21
TPSA
90.65

LogP / Solubility

WLOGP
2.09
MLOGP
1.85
XLogP3
1.7
Consensus LogP
1.88
Log S (ESOL)
-3.16
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.6
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.12

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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