C700-2628 Screening compound: 4-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}pyrrolo[1,2-a]quinoxaline

C700-2628 Screening compound: 4-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}pyrrolo[1,2-a]quinoxaline
C700-2628 Screening compound: 4-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}pyrrolo[1,2-a]quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2628
4-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}pyrrolo[1,2-a]quinoxaline

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

C700-2628

Molecular Formula

C22H21FN4O2S (C22 H21 FN4 O2 S)

Compound Name

4-{4-[(4-fluorophenyl)sulfonyl]-1,4-diazepan-1-yl}pyrrolo[1,2-a]quinoxaline

IUPAC name

1-(4-fluorobenzenesulfonyl)-4-{pyrrolo[12-a]quinoxalin-4-yl}-14-diazepane

SMILES

O=S(c(cc1)ccc1F)(N(CCC1)CCN1c1nc(cccc2)c2n2c1ccc2)=O

InChI

InChI=1S/C22H21FN4O2S/c23-17-8-10-18(11-9-17)30(28,29)26-13-4-12-25(15-16-26)22-21-7-3-14-27(21)20-6-2-1-5-19(20)24-22/h1-3,5-11,14H,4,12-13,15-16H2

InChI Key

USUBQEFKMFBCSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.426

Distribution Coefficient, logD

4.421

Water Solubility, LogSw

-4.35

Polar Surface Area

43.008

Acid Dissociation Constant (pKa)

24.37

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.73

C700-2628 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C700-2628 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2628?
Check Price and Availability of C700-2628, 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 C700-2628 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2628
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2628
  • 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 C700-2628 available by request