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CAS 174565-63-0 7-nitroquinazoline-2,4(1H,3H)-dione molecular structure lightbox
CAS RN: 174565-63-0

7-nitroquinazoline-2,4(1H,3H)-dione

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250927 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251205 1g / 5g / 25g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batchno.20250721 250mg In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250922 25g In stock Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250930 5g Out of stock Inquiry
  • Product code: SSC-076569
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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: 5g
  • 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 174565-63-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

174565-63-0 / 7-nitro-1H-quinazoline-2,4-dione

Standard CAS: 174565-63-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
174565-63-0
Multi CAS
No
Molecular Formula
C8H5N3O4
Molecular Weight
207.140000
Exact Mass
207.028006
SMILES
C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)NC2=O
InChI
InChI=1S/C8H5N3O4/c12-7-5-2-1-4(11(14)15)3-6(5)9-8(13)10-7/h1-3H,(H2,9,10,12,13)
InChIKey
FDAQHIHYBBEDQQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
51.84
TPSA
108.86

LogP / Solubility

WLOGP
0.12
MLOGP
0.11
XLogP3
0.6
Consensus LogP
0.28
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-1.35
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.23
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)
-3.9

Drug-likeness / Medicinal Chemistry

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

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