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CAS 61494-42-6 N,2-dihydroxy-5-nitrobenzaMide molecular structure lightbox
CAS RN: 61494-42-6

N,2-dihydroxy-5-nitrobenzaMide

Product Availability

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250805 1g In stock Shanghai Inquiry
Batchno.20250522 250mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-170398
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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 61494-42-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

61494-42-6 / N,2-dihydroxy-5-nitrobenzamide

Standard CAS: 61494-42-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
61494-42-6
Multi CAS
No
Molecular Formula
C7H6N2O5
Molecular Weight
198.130000
Exact Mass
198.027671
InChI
InChI=1S/C7H6N2O5/c10-6-2-1-4(9(13)14)3-5(6)7(11)8-12/h1-3,10,12H,(H,8,11)
InChIKey
FYKZWVSSOQBABP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
3
Molar refractivity
44.01
TPSA
112.7

LogP / Solubility

WLOGP
0.42
MLOGP
0.37
XLogP3
1.6
Consensus LogP
0.8
Log S (ESOL)
-1.52
Class (ESOL)
Soluble
Log S (Ali)
-1.49
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.54
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.63

Drug-likeness / Medicinal Chemistry

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

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