Screening compound: KREKJOJEBLKKAI-UHFFFAOYSA-N

Screening compound: KREKJOJEBLKKAI-UHFFFAOYSA-N
Screening compound: KREKJOJEBLKKAI-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
KREKJOJEBLKKAI-UHFFFAOYSA-N

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4568-7315

Molecular Formula

C25H25BrFNO3S (C25 H25 BrFNO3 S)

Compound Name

2-methylpropyl 4-(5-bromo-2-fluorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

IUPAC name

2-methylpropyl 4-(5-bromo-2-fluorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-145678-hexahydroquinoline-3-carboxylate

SMILES

CC(C)COC(C(C1c(cc(cc2)Br)c2F)=C(C)NC(CC(C2)c3cccs3)=C1C2=O)=O

InChI

InChI=1S/C25H25BrFNO3S/c1-13(2)12-31-25(30)22-14(3)28-19-9-15(21-5-4-8-32-21)10-20(29)24(19)23(22)17-11-16(26)6-7-18(17)27/h4-8,11,13,15,23,28H,9-10,12H2,1-3H3

InChI Key

KREKJOJEBLKKAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03370915

KREKJOJEBLKKAI-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with KREKJOJEBLKKAI-UHFFFAOYSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound KREKJOJEBLKKAI-UHFFFAOYSA-N?
Check Price and Availability of KREKJOJEBLKKAI-UHFFFAOYSA-N, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of KREKJOJEBLKKAI-UHFFFAOYSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for KREKJOJEBLKKAI-UHFFFAOYSA-N
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for KREKJOJEBLKKAI-UHFFFAOYSA-N
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of KREKJOJEBLKKAI-UHFFFAOYSA-N available by request