3909-8565 Screening compound: 3-[(diethylcarbamoyl)methyl]-N-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

3909-8565 Screening compound: 3-[(diethylcarbamoyl)methyl]-N-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
3909-8565 Screening compound: 3-[(diethylcarbamoyl)methyl]-N-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-8565
3-[(diethylcarbamoyl)methyl]-N-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

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

3909-8565

Molecular Formula

C22H26N4O5S (C22 H26 N4 O5 S)

Compound Name

3-[(diethylcarbamoyl)methyl]-N-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

3-[(diethylcarbamoyl)methyl]-N-(34-dimethoxyphenyl)-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxamide

SMILES

CCN(CC)C(CN(C=Nc1c2c(C)c(C(Nc(cc3)cc(OC)c3OC)=O)s1)C2=O)=O

InChI

InChI=1S/C22H26N4O5S/c1-6-25(7-2)17(27)11-26-12-23-21-18(22(26)29)13(3)19(32-21)20(28)24-14-8-9-15(30-4)16(10-14)31-5/h8-10,12H,6-7,11H2,1-5H3,(H,24,28)

InChI Key

WPXBXFQPHVWGFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05716010

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.568

Distribution Coefficient, logD

1.551

Water Solubility, LogSw

-2.68

Polar Surface Area

80.269

Acid Dissociation Constant (pKa)

8.80

Base Dissociation Constant (pKb)

1.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

3909-8565 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 3909-8565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-8565?
Check Price and Availability of 3909-8565, 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 3909-8565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-8565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-8565
  • 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 3909-8565 available by request