F669-0171 Screening compound: 5-[4-(ethanesulfonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

F669-0171 Screening compound: 5-[4-(ethanesulfonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
F669-0171 Screening compound: 5-[4-(ethanesulfonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F669-0171
5-[4-(ethanesulfonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

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

F669-0171

Molecular Formula

C18H24N4O4S (C18 H24 N4 O4 S)

Compound Name

5-[4-(ethanesulfonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

IUPAC name

5-[4-(ethanesulfonyl)piperazin-1-yl]-36-dimethyl-1-phenyl-1234-tetrahydropyrimidine-24-dione

SMILES

CCS(N(CC1)CCN1C(C(N1C)=O)=C(C)N(c2ccccc2)C1=O)(=O)=O

InChI

InChI=1S/C18H24N4O4S/c1-4-27(25,26)21-12-10-20(11-13-21)16-14(2)22(15-8-6-5-7-9-15)18(24)19(3)17(16)23/h5-9H,4,10-13H2,1-3H3

InChI Key

ZHRWBCWEFAFQPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.106

Distribution Coefficient, logD

1.106

Water Solubility, LogSw

-2.18

Polar Surface Area

66.249

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

F669-0171 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with F669-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F669-0171?
Check Price and Availability of F669-0171, 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 F669-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F669-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F669-0171
  • 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 F669-0171 available by request