D271-0001 Screening compound: 5-(3,4-dihydroxyphenyl)-2-(methylsulfanyl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

D271-0001 Screening compound: 5-(3,4-dihydroxyphenyl)-2-(methylsulfanyl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione
D271-0001 Screening compound: 5-(3,4-dihydroxyphenyl)-2-(methylsulfanyl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D271-0001
5-(3,4-dihydroxyphenyl)-2-(methylsulfanyl)-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

D271-0001

Molecular Formula

C14H13N3O4S (C14 H13 N3 O4 S)

Compound Name

5-(3,4-dihydroxyphenyl)-2-(methylsulfanyl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

IUPAC name

5-(34-dihydroxyphenyl)-2-(methylsulfanyl)-3H4H5H6H7H8H-pyrido[23-d]pyrimidine-47-dione

SMILES

CSC(N1)=NC(NC(CC2c(cc3)cc(O)c3O)=O)=C2C1=O

InChI

InChI=1S/C14H13N3O4S/c1-22-14-16-12-11(13(21)17-14)7(5-10(20)15-12)6-2-3-8(18)9(19)4-6/h2-4,7,18-19H,5H2,1H3,(H2,15,16,17,20,21)/t7-/m1/s1

InChI Key

XKTSYJVDLUIIRM-SSDOTTSWSA-N

MDL Number (MFCD)

MFCD14816136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.097

Distribution Coefficient, logD

0.080

Water Solubility, LogSw

-2.16

Polar Surface Area

91.236

Acid Dissociation Constant (pKa)

6.44

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with D271-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D271-0001?
Check Price and Availability of D271-0001, 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 D271-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D271-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D271-0001
  • 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 D271-0001 available by request