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CAS 110683-22-2 8-Amino-4-oxo-2-(tetrazol-5-yl)-4H-1-benzopyran molecular structure lightbox
CAS RN: 110683-22-2

8-Amino-4-oxo-2-(tetrazol-5-yl)-4H-1-benzopyran

Product Availability

Choose a grade to view its available package options.

11 package records10 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250705 100g In stock Inquiry
Batchno.20250430 10g In stock Inquiry
Batchno.20260609 1g In stock Inquiry
Batchno.20260620 25g In stock Inquiry
Batchno.20260528 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260130 5g / 25g Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250217 100g In stock Shanghai Inquiry
Batchno.20250129 10g In stock Shanghai Inquiry
Batchno.20260516 1g In stock Shanghai Inquiry
Batchno.20260521 25g In stock Shanghai Inquiry
Batchno.20250712 5g In stock Shanghai Inquiry
  • Product code: SSC-011654
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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: 25g
  • 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 110683-22-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shanghai Inquiry

110683-22-2 / 8-amino-2-(2H-tetrazol-5-yl)chromen-4-one

8-amino-2-(2H-tetrazol-5-yl)-4H-1-Benzopyran-4-one | DTXSID90474135 | RefChem:311721

Standard CAS: 110683-22-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
110683-22-2
Multi CAS
Yes
Molecular Formula
C10H7N5O2
Molecular Weight
229.190000
Exact Mass
229.059974
SMILES
C1=CC2=C(C(=C1)N)OC(=CC2=O)C3=NNN=N3
InChI
InChI=1S/C10H7N5O2/c11-6-3-1-2-5-7(16)4-8(17-9(5)6)10-12-14-15-13-10/h1-4H,11H2,(H,12,13,14,15)
InChIKey
GSZQAIJMONCDFZ-UHFFFAOYSA-N
Synonyms
8-amino-2-(2H-tetrazol-5-yl)-4H-1-Benzopyran-4-one DTXSID90474135 RefChem:311721 DTXCID00424949 8-Amino-2-(1H-tetrazol-5-yl)-4H-chromen-4-one

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
6
H-bond donors
2
Molar refractivity
60.07
TPSA
110.69

LogP / Solubility

WLOGP
0.56
MLOGP
0.49
XLogP3
0.1
Consensus LogP
0.38
Log S (ESOL)
-2.2
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.84
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.73
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)
-3.72

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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