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CAS 1166232-68-3 N,N’-(Naphthalene-1,5-diyl)bis[2-(aminooxy)acetamide] molecular structure lightbox
CAS RN: 1166232-68-3

N,N’-(Naphthalene-1,5-diyl)bis[2-(aminooxy)acetamide]

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260604 10mg / 50mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-016565
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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 1166232-68-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1166232-68-3 / 2-aminooxy-N-[5-[(2-aminooxyacetyl)amino]naphthalen-1-yl]acetamide

N,N'-(Naphthalene-1,5-diyl)bis[2-(aminooxy)acetamide] | N,N'-(Naphthalene-1,5-diyl)bis(2-(aminooxy)acetamide) | RefChem:821676

Standard CAS: 1166232-68-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1166232-68-3
Multi CAS
No
Molecular Formula
C14H16N4O4
Molecular Weight
304.300000
Exact Mass
304.117155
SMILES
C1=CC2=C(C=CC=C2NC(=O)CON)C(=C1)NC(=O)CON
InChI
InChI=1S/C14H16N4O4/c15-21-7-13(19)17-11-5-1-3-9-10(11)4-2-6-12(9)18-14(20)8-22-16/h1-6H,7-8,15-16H2,(H,17,19)(H,18,20)
InChIKey
MLWDZDBSRKXTQH-UHFFFAOYSA-N
Synonyms
N,N'-(Naphthalene-1,5-diyl)bis[2-(aminooxy)acetamide] N,N'-(Naphthalene-1,5-diyl)bis(2-(aminooxy)acetamide) RefChem:821676 878-809-0 MFCD32068076

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
10
Fraction Csp3
0.14
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
4
Molar refractivity
81.49
TPSA
128.7

LogP / Solubility

WLOGP
0.5
MLOGP
0.45
XLogP3
0.9
Consensus LogP
0.62
Log S (ESOL)
-1.98
Class (ESOL)
Soluble
Log S (Ali)
-2.41
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.77
Class (SILICOS-IT)
Moderately 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)
-4.22

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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