D392-0223 Screening compound: 5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

D392-0223 Screening compound: 5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione
D392-0223 Screening compound: 5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D392-0223
5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

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

D392-0223

Molecular Formula

C23H22FN3O4S (C23 H22 FN3 O4 S)

Compound Name

5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

IUPAC name

5-(3-ethoxy-4-methoxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-3H4H5H6H7H8H-pyrido[23-d]pyrimidine-47-dione

SMILES

CCOc(cc(C(CC(N1)=O)C(C(N2)=O)=C1N=C2SCc(cc1)ccc1F)cc1)c1OC

InChI

InChI=1S/C23H22FN3O4S/c1-3-31-18-10-14(6-9-17(18)30-2)16-11-19(28)25-21-20(16)22(29)27-23(26-21)32-12-13-4-7-15(24)8-5-13/h4-10,16H,3,11-12H2,1-2H3,(H2,25,26,27,28,29)/t16-/m1/s1

InChI Key

XMWGAHWSHLZTEH-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD27582961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.091

Distribution Coefficient, logD

2.081

Water Solubility, LogSw

-3.03

Polar Surface Area

72.709

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

1.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with D392-0223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D392-0223?
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What is the minimum amount of D392-0223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D392-0223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D392-0223
  • 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 D392-0223 available by request