Y504-7745 Screening compound: methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate

Y504-7745 Screening compound: methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Y504-7745 Screening compound: methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y504-7745
methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate

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

Y504-7745

Molecular Formula

C19H19N3O5S (C19 H19 N3 O5 S)

Compound Name

methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate

IUPAC name

methyl 1-(2-methoxyethyl)-7-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1H4H-pyrido[23-d]pyrimidine-5-carboxylate

SMILES

COCCN(c1c2c(C(OC)=O)cc(-c3cc(OC)ccc3)n1)C(S)=NC2=O

InChI

InChI=1S/C19H19N3O5S/c1-25-8-7-22-16-15(17(23)21-19(22)28)13(18(24)27-3)10-14(20-16)11-5-4-6-12(9-11)26-2/h4-6,9-10H,7-8H2,1-3H3,(H,21,23,28)

InChI Key

CLSFJHNFFHDEOK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.020

Distribution Coefficient, logD

-0.508

Water Solubility, LogSw

-3.22

Polar Surface Area

72.224

Acid Dissociation Constant (pKa)

3.87

Base Dissociation Constant (pKb)

2.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.32

Y504-7745 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y504-7745 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y504-7745?
Check Price and Availability of Y504-7745, 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 Y504-7745 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y504-7745
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y504-7745
  • 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 Y504-7745 available by request