MedKoo Cat#: 130474 | Name: SE-1

Description:

WARNING: This product is for research use only, not for human or veterinary use.

SE-1, also known as OSSL_051168, is an RhaS and RhaR (of the AraC family) protein inhibitor, in turn interfering with DNA binding and inhibiting VirF. SE-1 may prove to be useful as an antibacterial agent.

Chemical Structure

SE-1
SE-1
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 130474

Name: SE-1

CAS#: N/A

Chemical Formula: C23H23N3O2

Exact Mass: 373.1790

Molecular Weight: 373.46

Elemental Analysis: C, 73.97; H, 6.21; N, 11.25; O, 8.57

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
SE-1; OSSL_051168; OSSL-051168; OSSL 051168
IUPAC/Chemical Name
1'-butyl-4'-(nitromethyl)-1',4'-dihydro-2,3'-biquinoline
InChi Key
TWSGBFAOSUKOKN-UHFFFAOYSA-N
InChi Code
InChI=1S/C23H23N3O2/c1-2-3-14-25-15-20(22-13-12-17-8-4-6-10-21(17)24-22)19(16-26(27)28)18-9-5-7-11-23(18)25/h4-13,15,19H,2-3,14,16H2,1H3
SMILES Code
O=[N+](CC1C(C2=NC3=CC=CC=C3C=C2)=CN(CCCC)C4=C1C=CC=C4)[O-]
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 373.46 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1. Koppolu V, Osaka I, Skredenske JM, Kettle B, Hefty PS, Li J, Egan SM. Small-molecule inhibitor of the Shigella flexneri master virulence regulator VirF. Infect Immun. 2013 Nov;81(11):4220-31. doi: 10.1128/IAI.00919-13. Epub 2013 Sep 3. PMID: 24002059; PMCID: PMC3811841. 2. Skredenske JM, Koppolu V, Kolin A, Deng J, Kettle B, Taylor B, Egan SM. Identification of a small-molecule inhibitor of bacterial AraC family activators. J Biomol Screen. 2013 Jun;18(5):588-98. doi: 10.1177/1087057112474690. Epub 2013 Jan 30. PMID: 23364515; PMCID: PMC3663881.