8018-9269 Screening compound: 7-methyl-6-[(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

8018-9269 Screening compound: 7-methyl-6-[(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one
8018-9269 Screening compound: 7-methyl-6-[(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9269
7-methyl-6-[(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

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

8018-9269

Molecular Formula

C17H15N3O5S (C17 H15 N3 O5 S)

Compound Name

7-methyl-6-[(3-oxo-1,2,3,4-tetrahydroquinoxalin-1-yl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one

IUPAC name

7-methyl-6-[(3-oxo-1234-tetrahydroquinoxalin-1-yl)sulfonyl]-34-dihydro-2H-14-benzoxazin-3-one

SMILES

Cc(cc(c(N1)c2)OCC1=O)c2S(N(C1)c(cccc2)c2NC1=O)(=O)=O

InChI

InChI=1S/C17H15N3O5S/c1-10-6-14-12(19-17(22)9-25-14)7-15(10)26(23,24)20-8-16(21)18-11-4-2-3-5-13(11)20/h2-7H,8-9H2,1H3,(H,18,21)(H,19,22)

InChI Key

RMQWSKQCKGHBJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09063082

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.118

Distribution Coefficient, logD

1.117

Water Solubility, LogSw

-2.52

Polar Surface Area

89.495

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

-2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

8018-9269 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

BRD4 Targeted Library (4534 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8018-9269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9269?
Check Price and Availability of 8018-9269, 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 8018-9269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9269
  • 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 8018-9269 available by request