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CAS 433252-24-5 BENZOFURAN-2-CARBOXYLIC ACID (4-AMINO-2-METHYL-PHENYL)-AMIDE molecular structure lightbox
CAS RN: 433252-24-5

BENZOFURAN-2-CARBOXYLIC ACID (4-AMINO-2-METHYL-PHENYL)-AMIDE

  • Product code: SSC-151583
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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 433252-24-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

433252-24-5 / N-(4-amino-2-methylphenyl)-1-benzofuran-2-carboxamide

Standard CAS: 433252-24-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
433252-24-5
Multi CAS
Yes
Molecular Formula
C16H14N2O2
Molecular Weight
266.290000
Exact Mass
266.105528
InChI
InChI=1S/C16H14N2O2/c1-10-8-12(17)6-7-13(10)18-16(19)15-9-11-4-2-3-5-14(11)20-15/h2-9H,17H2,1H3,(H,18,19)
InChIKey
OGECFYOWRHXWKL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
15
Fraction Csp3
0.06
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
79.76
TPSA
68.26

LogP / Solubility

WLOGP
3.58
MLOGP
3.15
XLogP3
3.2
Consensus LogP
3.31
Log S (ESOL)
-4.17
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.81

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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