[email protected]
CAS 1206896-20-9 2-t-Butyl-6-chlorobenzoxazole-7-(N-Methyl-N-Methoxy)sulfonaMide molecular structure lightbox
CAS RN: 1206896-20-9

2-t-Butyl-6-chlorobenzoxazole-7-(N-Methyl-N-Methoxy)sulfonaMide

Product Availability

Choose a grade to view its available package options.

4 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260327 100mg Out of stock Inquiry
Batchno.20250511 1g Out of stock Inquiry
Batchno.20250405 250mg Out of stock Inquiry
Batchno.20260416 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-021771
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: 5g
  • 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 1206896-20-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

1206896-20-9 / 2-tert-butyl-6-chloro-N-methoxy-N-methyl-1,3-benzoxazole-7-sulfonamide

2-tert-butyl-6-chloro-N-methoxy-N-methyl-1,3-benzoxazole-7-sulfonamide | DTXSID10857067 | RefChem:267159

Standard CAS: 1206896-20-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1206896-20-9
Multi CAS
No
Molecular Formula
C13H17ClN2O4S
Molecular Weight
332.800000
Exact Mass
332.059756
SMILES
CC(C)(C)C1=NC2=C(O1)C(=C(C=C2)Cl)S(=O)(=O)N(C)OC
InChI
InChI=1S/C13H17ClN2O4S/c1-13(2,3)12-15-9-7-6-8(14)11(10(9)20-12)21(17,18)16(4)19-5/h6-7H,1-5H3
InChIKey
ALPWDUCGTAPWMC-UHFFFAOYSA-N
Synonyms
2-tert-butyl-6-chloro-N-methoxy-N-methyl-1,3-benzoxazole-7-sulfonamide DTXSID10857067 RefChem:267159 DTXCID90807808 2-(tert-Butyl)-6-chloro-N-methoxy-N-methylbenzo[d]oxazole-7-sulfonamide

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
9
Fraction Csp3
0.46
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
79.68
TPSA
72.64

LogP / Solubility

WLOGP
2.96
MLOGP
2.62
XLogP3
3.3
Consensus LogP
2.96
Log S (ESOL)
-3.89
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.43
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.64
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.65

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

Customers Also Viewed

Get In Touch

Contact Us