3909-7561 Screening compound: ethyl 4-[benzyl(methyl)amino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate

3909-7561 Screening compound: ethyl 4-[benzyl(methyl)amino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate
3909-7561 Screening compound: ethyl 4-[benzyl(methyl)amino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-7561
ethyl 4-[benzyl(methyl)amino]-2,5-dimethylthieno[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

3909-7561

Molecular Formula

C19H21N3O2S (C19 H21 N3 O2 S)

Compound Name

ethyl 4-[benzyl(methyl)amino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate

IUPAC name

ethyl 4-[benzyl(methyl)amino]-25-dimethylthieno[23-d]pyrimidine-6-carboxylate

SMILES

CCOC(c1c(C)c2c(N(C)Cc3ccccc3)nc(C)nc2s1)=O

InChI

InChI=1S/C19H21N3O2S/c1-5-24-19(23)16-12(2)15-17(20-13(3)21-18(15)25-16)22(4)11-14-9-7-6-8-10-14/h6-10H,5,11H2,1-4H3

InChI Key

FPBQKZCCEPUYOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04778134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.705

Distribution Coefficient, logD

3.806

Water Solubility, LogSw

-4.62

Polar Surface Area

43.168

Acid Dissociation Constant (pKa)

21.06

Base Dissociation Constant (pKb)

8.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

3909-7561 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 3909-7561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-7561?
Check Price and Availability of 3909-7561, 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 3909-7561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-7561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-7561
  • 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 3909-7561 available by request