D271-0121 Screening compound: 5-(2,5-dimethylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione

D271-0121 Screening compound: 5-(2,5-dimethylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidine-4,7-dione
D271-0121 Screening compound: 5-(2,5-dimethylphenyl)-2-{[(3-methylphenyl)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 D271-0121
5-(2,5-dimethylphenyl)-2-{[(3-methylphenyl)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

D271-0121

Molecular Formula

C23H23N3O2S (C23 H23 N3 O2 S)

Compound Name

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

IUPAC name

5-(25-dimethylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-3H4H5H6H7H8H-pyrido[23-d]pyrimidine-47-dione

SMILES

Cc1cccc(CSC(N2)=NC(NC(CC3c4c(C)ccc(C)c4)=O)=C3C2=O)c1

InChI

InChI=1S/C23H23N3O2S/c1-13-5-4-6-16(9-13)12-29-23-25-21-20(22(28)26-23)18(11-19(27)24-21)17-10-14(2)7-8-15(17)3/h4-10,18H,11-12H2,1-3H3,(H2,24,25,26,27,28)/t18-/m1/s1

InChI Key

AXAZYNVDCPQRQC-GOSISDBHSA-N

MDL Number (MFCD)

MFCD26967501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.160

Distribution Coefficient, logD

4.150

Water Solubility, LogSw

-4.15

Polar Surface Area

57.868

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with D271-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D271-0121?
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What is the minimum amount of D271-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D271-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D271-0121
  • 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 D271-0121 available by request