G313-0390 Screening compound: 3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one

G313-0390 Screening compound: 3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one
G313-0390 Screening compound: 3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G313-0390
3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-1,4-dihydro-1,8-naphthyridin-4-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

G313-0390

Molecular Formula

C22H17ClN2O3S (C22 H17 ClN2 O3 S)

Compound Name

3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-1,4-dihydro-1,8-naphthyridin-4-one

IUPAC name

3-(benzenesulfonyl)-1-[(4-chlorophenyl)methyl]-7-methyl-14-dihydro-18-naphthyridin-4-one

SMILES

Cc1ccc(C(C(S(c2ccccc2)(=O)=O)=CN2Cc(cc3)ccc3Cl)=O)c2n1

InChI

InChI=1S/C22H17ClN2O3S/c1-15-7-12-19-21(26)20(29(27,28)18-5-3-2-4-6-18)14-25(22(19)24-15)13-16-8-10-17(23)11-9-16/h2-12,14H,13H2,1H3

InChI Key

PIYXDZMLGCTTFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.766

Distribution Coefficient, logD

4.766

Water Solubility, LogSw

-4.99

Polar Surface Area

54.768

Acid Dissociation Constant (pKa)

25.72

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

G313-0390 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G313-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G313-0390?
Check Price and Availability of G313-0390, 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 G313-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G313-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G313-0390
  • 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 G313-0390 available by request