C241-2119 Screening compound: benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetate

C241-2119 Screening compound: benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetate
C241-2119 Screening compound: benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-2119
benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}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

C241-2119

Molecular Formula

C26H25N3O5S (C26 H25 N3 O5 S)

Compound Name

benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetate

IUPAC name

benzyl 2-{3-[3-(benzylcarbamoyl)propyl]-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-1-yl}acetate

SMILES

O=C(CCCN(C(c(scc1)c1N1CC(OCc2ccccc2)=O)=O)C1=O)NCc1ccccc1

InChI

InChI=1S/C26H25N3O5S/c30-22(27-16-19-8-3-1-4-9-19)12-7-14-28-25(32)24-21(13-15-35-24)29(26(28)33)17-23(31)34-18-20-10-5-2-6-11-20/h1-6,8-11,13,15H,7,12,14,16-18H2,(H,27,30)

InChI Key

VQKDSZSTKGOUFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08540764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.258

Distribution Coefficient, logD

3.258

Water Solubility, LogSw

-3.38

Polar Surface Area

77.269

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

-1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C241-2119 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C241-2119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-2119?
Check Price and Availability of C241-2119, 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 C241-2119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-2119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-2119
  • 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 C241-2119 available by request