K285-5195 Screening compound: methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate

K285-5195 Screening compound: methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
K285-5195 Screening compound: methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K285-5195
methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-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

K285-5195

Molecular Formula

C15H20N4O5S2 (C15 H20 N4 O5 S2)

Compound Name

methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate

IUPAC name

methyl 3-amino-2-({[(3-methoxypropyl)carbamoyl]methyl}sulfanyl)-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxylate

SMILES

Cc1c(C(OC)=O)sc(N=C(N2N)SCC(NCCCOC)=O)c1C2=O

InChI

InChI=1S/C15H20N4O5S2/c1-8-10-12(26-11(8)14(22)24-3)18-15(19(16)13(10)21)25-7-9(20)17-5-4-6-23-2/h4-7,16H2,1-3H3,(H,17,20)

InChI Key

KYEGPZNLJCJVFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15090002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.271

Distribution Coefficient, logD

0.271

Water Solubility, LogSw

-1.28

Polar Surface Area

96.551

Acid Dissociation Constant (pKa)

16.02

Base Dissociation Constant (pKb)

0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

K285-5195 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with K285-5195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K285-5195?
Check Price and Availability of K285-5195, 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 K285-5195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K285-5195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K285-5195
  • 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 K285-5195 available by request