7834-0167 Screening compound: 2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-1,4-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide

7834-0167 Screening compound: 2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-1,4-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide
7834-0167 Screening compound: 2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-1,4-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7834-0167
2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-1,4-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide

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

7834-0167

Molecular Formula

C18H18N4O3S (C18 H18 N4 O3 S)

Compound Name

2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-1,4-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide

IUPAC name

2-({6-amino-1-[(furan-2-yl)methyl]-4-oxo-14-dihydropyrimidin-2-yl}sulfanyl)-N-(4-methylphenyl)acetamide

SMILES

Cc(cc1)ccc1NC(CSC(N(Cc1ccco1)C(N)=C1)=NC1=O)=O

InChI

InChI=1S/C18H18N4O3S/c1-12-4-6-13(7-5-12)20-17(24)11-26-18-21-16(23)9-15(19)22(18)10-14-3-2-8-25-14/h2-9H,10-11,19H2,1H3,(H,20,24)

InChI Key

FRLINDTWUMFURC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06757763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.148

Distribution Coefficient, logD

2.148

Water Solubility, LogSw

-2.65

Polar Surface Area

75.711

Acid Dissociation Constant (pKa)

12.90

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

7834-0167 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7834-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7834-0167?
Check Price and Availability of 7834-0167, 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 7834-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7834-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7834-0167
  • 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 7834-0167 available by request