C241-1739 Screening compound: N-benzyl-2-(2,4-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-ethylacetamide

C241-1739 Screening compound: N-benzyl-2-(2,4-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-ethylacetamide
C241-1739 Screening compound: N-benzyl-2-(2,4-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-ethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1739
N-benzyl-2-(2,4-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-ethylacetamide

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

C241-1739

Molecular Formula

C27H28N4O4S (C27 H28 N4 O4 S)

Compound Name

N-benzyl-2-(2,4-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl)-N-ethylacetamide

IUPAC name

N-benzyl-2-(24-dioxo-3-{[(2-phenylethyl)carbamoyl]methyl}-1H2H3H4H-thieno[32-d]pyrimidin-1-yl)-N-ethylacetamide

SMILES

CCN(Cc1ccccc1)C(CN(c1c(C(N2CC(NCCc3ccccc3)=O)=O)scc1)C2=O)=O

InChI

InChI=1S/C27H28N4O4S/c1-2-29(17-21-11-7-4-8-12-21)24(33)19-30-22-14-16-36-25(22)26(34)31(27(30)35)18-23(32)28-15-13-20-9-5-3-6-10-20/h3-12,14,16H,2,13,15,17-19H2,1H3,(H,28,32)

InChI Key

ZPANFQZNMBWXHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.676

Distribution Coefficient, logD

2.676

Water Solubility, LogSw

-2.94

Polar Surface Area

72.278

Acid Dissociation Constant (pKa)

14.99

Base Dissociation Constant (pKb)

0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with C241-1739 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1739?
Check Price and Availability of C241-1739, 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 C241-1739 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1739
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1739
  • 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 C241-1739 available by request