J023-0183 Screening compound: 2-(benzylsulfanyl)-N-(2-chlorophenyl)-4,7-dioxo-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxamide

J023-0183 Screening compound: 2-(benzylsulfanyl)-N-(2-chlorophenyl)-4,7-dioxo-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxamide
J023-0183 Screening compound: 2-(benzylsulfanyl)-N-(2-chlorophenyl)-4,7-dioxo-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J023-0183
2-(benzylsulfanyl)-N-(2-chlorophenyl)-4,7-dioxo-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxamide

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

J023-0183

Molecular Formula

C21H17ClN4O3S (C21 H17 ClN4 O3 S)

Compound Name

2-(benzylsulfanyl)-N-(2-chlorophenyl)-4,7-dioxo-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-5-carboxamide

IUPAC name

2-(benzylsulfanyl)-N-(2-chlorophenyl)-47-dioxo-3H4H5H6H7H8H-pyrido[23-d]pyrimidine-5-carboxamide

SMILES

O=C(C(CC(N1)=O)C(C(N2)=O)=C1N=C2SCc1ccccc1)Nc(cccc1)c1Cl

InChI

InChI=1S/C21H17ClN4O3S/c22-14-8-4-5-9-15(14)23-19(28)13-10-16(27)24-18-17(13)20(29)26-21(25-18)30-11-12-6-2-1-3-7-12/h1-9,13H,10-11H2,(H,23,28)(H2,24,25,26,27,29)/t13-/m1/s1

InChI Key

YNQAWSDIJKOGMJ-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD27219079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.91

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.847

Distribution Coefficient, logD

1.839

Water Solubility, LogSw

-2.51

Polar Surface Area

80.533

Acid Dissociation Constant (pKa)

9.15

Base Dissociation Constant (pKb)

-0.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with J023-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J023-0183?
Check Price and Availability of J023-0183, 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 J023-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J023-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J023-0183
  • 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 J023-0183 available by request