C060-0068 Screening compound: 4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)methyl]butanamide

C060-0068 Screening compound: 4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)methyl]butanamide
C060-0068 Screening compound: 4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C060-0068
4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)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

C060-0068

Molecular Formula

C19H22N4O4S (C19 H22 N4 O4 S)

Compound Name

4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)methyl]butanamide

IUPAC name

4-(2-{56-dimethyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}acetamido)-N-[(furan-2-yl)methyl]butanamide

SMILES

Cc1c(C)sc(N=CN2CC(NCCCC(NCc3ccco3)=O)=O)c1C2=O

InChI

InChI=1S/C19H22N4O4S/c1-12-13(2)28-18-17(12)19(26)23(11-22-18)10-16(25)20-7-3-6-15(24)21-9-14-5-4-8-27-14/h4-5,8,11H,3,6-7,9-10H2,1-2H3,(H,20,25)(H,21,24)

InChI Key

SYXYAAGMYCEOLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05026598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.965

Distribution Coefficient, logD

0.965

Water Solubility, LogSw

-2.15

Polar Surface Area

82.774

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with C060-0068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C060-0068?
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What is the minimum amount of C060-0068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C060-0068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C060-0068
  • 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 C060-0068 available by request