C241-1384 Screening compound: 4-[1-(carbamoylmethyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide

C241-1384 Screening compound: 4-[1-(carbamoylmethyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide
C241-1384 Screening compound: 4-[1-(carbamoylmethyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C241-1384
4-[1-(carbamoylmethyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide

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

C241-1384

Molecular Formula

C20H22N4O4S (C20 H22 N4 O4 S)

Compound Name

4-[1-(carbamoylmethyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide

IUPAC name

4-[1-(carbamoylmethyl)-24-dioxo-1H2H3H4H-thieno[32-d]pyrimidin-3-yl]-N-[(4-methylphenyl)methyl]butanamide

SMILES

Cc1ccc(CNC(CCCN(C(c(scc2)c2N2CC(N)=O)=O)C2=O)=O)cc1

InChI

InChI=1S/C20H22N4O4S/c1-13-4-6-14(7-5-13)11-22-17(26)3-2-9-23-19(27)18-15(8-10-29-18)24(20(23)28)12-16(21)25/h4-8,10H,2-3,9,11-12H2,1H3,(H2,21,25)(H,22,26)

InChI Key

HJWXGBMKWCWUMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14734426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.031

Distribution Coefficient, logD

1.031

Water Solubility, LogSw

-2.20

Polar Surface Area

90.394

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with C241-1384 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C241-1384?
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What is the minimum amount of C241-1384 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C241-1384
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C241-1384
  • 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 C241-1384 available by request