8017-3925 Screening compound: methyl N-(4,5-dimethoxy-2-{[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]sulfonyl}phenethyl)carbamate

8017-3925 Screening compound: methyl N-(4,5-dimethoxy-2-{[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]sulfonyl}phenethyl)carbamate
8017-3925 Screening compound: methyl N-(4,5-dimethoxy-2-{[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]sulfonyl}phenethyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-3925
methyl N-(4,5-dimethoxy-2-{[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]sulfonyl}phenethyl)carbamate

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

8017-3925

Molecular Formula

C20H23N3O7S (C20 H23 N3 O7 S)

Compound Name

methyl N-(4,5-dimethoxy-2-{[3-oxo-3,4-dihydro-1(2H)-quinoxalinyl]sulfonyl}phenethyl)carbamate

IUPAC name

methyl N-(2-{45-dimethoxy-2-[(3-oxo-1234-tetrahydroquinoxalin-1-yl)sulfonyl]phenyl}ethyl)carbamate

SMILES

COC(NCCc(cc(c(OC)c1)OC)c1S(N(C1)c(cccc2)c2NC1=O)(=O)=O)=O

InChI

InChI=1S/C20H23N3O7S/c1-28-16-10-13(8-9-21-20(25)30-3)18(11-17(16)29-2)31(26,27)23-12-19(24)22-14-6-4-5-7-15(14)23/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,25)(H,22,24)

InChI Key

FJGQCKTZUJGEJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06016464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.193

Distribution Coefficient, logD

1.193

Water Solubility, LogSw

-2.45

Polar Surface Area

104.513

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with 8017-3925 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-3925?
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What is the minimum amount of 8017-3925 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-3925
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-3925
  • 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 8017-3925 available by request