[email protected]
CAS 26576-46-5 5-(Acetoacetamido)-2-benzimidazolinone molecular structure lightbox
CAS RN: 26576-46-5

5-(Acetoacetamido)-2-benzimidazolinone

Product Availability

Choose a grade to view its available package options.

9 package records9 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260616 100g In stock Inquiry
Batchno.20260409 2.5kg In stock Inquiry
Batchno.20260420 250g In stock Inquiry
Batchno.20250714 25g In stock Inquiry
Batchno.20250919 500g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251205 100g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260423 1kg In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251202 25g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251203 500g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: SSC-124600
GET A QUOTE
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: 100g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 26576-46-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Beijing Inquiry

26576-46-5 / 3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide

Standard CAS: 26576-46-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
26576-46-5
Multi CAS
No
Molecular Formula
C11H11N3O3
Molecular Weight
233.220000
Exact Mass
233.080041
SMILES
CC(=O)CC(=O)NC1=CC2=C(C=C1)NC(=O)N2
InChI
InChI=1S/C11H11N3O3/c1-6(15)4-10(16)12-7-2-3-8-9(5-7)14-11(17)13-8/h2-3,5H,4H2,1H3,(H,12,16)(H2,13,14,17)
InChIKey
VEMDQCGHZNXORX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
9
Fraction Csp3
0.18
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
3
Molar refractivity
62.85
TPSA
94.82

LogP / Solubility

WLOGP
0.77
MLOGP
0.68
XLogP3
0.1
Consensus LogP
0.52
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.03
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.18
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)
-3.59

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

Customers Also Viewed

Get In Touch

Contact Us