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CAS 63038-00-6 5-aminonaphthalene-1,4-dione molecular structure lightbox
CAS RN: 63038-00-6

5-aminonaphthalene-1,4-dione

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260310 100mg Out of stock 8-10 business days Inquiry
Batchno.20260307 100mg In stock Shanghai Inquiry
Batchno.20260409 1g In stock Shanghai Inquiry
Batchno.20260404 250mg In stock Shanghai, Shenzhen Inquiry
  • Product code: SSC-172532
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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: ＞97%
  • 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 63038-00-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

63038-00-6 / 5-aminonaphthalene-1,4-dione

Standard CAS: 63038-00-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
63038-00-6
Multi CAS
Yes
Molecular Formula
C10H7NO2
Molecular Weight
173.170000
Exact Mass
173.047678
InChI
InChI=1S/C10H7NO2/c11-7-3-1-2-6-8(12)4-5-9(13)10(6)7/h1-5H,11H2
InChIKey
PRIYDLUXFBTENF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
48.66
TPSA
60.16

LogP / Solubility

WLOGP
1.2
MLOGP
1.06
XLogP3
1.6
Consensus LogP
1.29
Log S (ESOL)
-2.01
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.85
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.78
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.92

Drug-likeness / Medicinal Chemistry

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

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