K892-0554 Screening compound: ethyl 2-({[4-(diethylamino)-2,5-dimethylthieno[2,3-d]pyrimidin-6-yl]carbonyl}amino)acetate

K892-0554 Screening compound: ethyl 2-({[4-(diethylamino)-2,5-dimethylthieno[2,3-d]pyrimidin-6-yl]carbonyl}amino)acetate
K892-0554 Screening compound: ethyl 2-({[4-(diethylamino)-2,5-dimethylthieno[2,3-d]pyrimidin-6-yl]carbonyl}amino)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K892-0554
ethyl 2-({[4-(diethylamino)-2,5-dimethylthieno[2,3-d]pyrimidin-6-yl]carbonyl}amino)acetate

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

K892-0554

Molecular Formula

C17H24N4O3S (C17 H24 N4 O3 S)

Compound Name

ethyl 2-({[4-(diethylamino)-2,5-dimethylthieno[2,3-d]pyrimidin-6-yl]carbonyl}amino)acetate

IUPAC name

ethyl 2-{[4-(diethylamino)-25-dimethylthieno[23-d]pyrimidin-6-yl]formamido}acetate

SMILES

CCN(CC)c1c(c(C)c(C(NCC(OCC)=O)=O)s2)c2nc(C)n1

InChI

InChI=1S/C17H24N4O3S/c1-6-21(7-2)15-13-10(4)14(25-17(13)20-11(5)19-15)16(23)18-9-12(22)24-8-3/h6-9H2,1-5H3,(H,18,23)

InChI Key

OSKGSJUXOFZSBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05030827

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.102

Distribution Coefficient, logD

2.676

Water Solubility, LogSw

-3.30

Polar Surface Area

67.040

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

7.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.94

K892-0554 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K892-0554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K892-0554?
Check Price and Availability of K892-0554, 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 K892-0554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K892-0554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K892-0554
  • 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 K892-0554 available by request