F667-0481 Screening compound: 5-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

F667-0481 Screening compound: 5-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-3,6-dimethyl-1-phenyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
F667-0481 Screening compound: 5-[4-(5-bromofuran-2-carbonyl)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 F667-0481
5-[4-(5-bromofuran-2-carbonyl)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

F667-0481

Molecular Formula

C21H21BrN4O4 (C21 H21 BrN4 O4)

Compound Name

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

IUPAC name

5-[4-(5-bromofuran-2-carbonyl)piperazin-1-yl]-36-dimethyl-1-phenyl-1234-tetrahydropyrimidine-24-dione

SMILES

CC(N(c1ccccc1)C(N(C)C1=O)=O)=C1N(CC1)CCN1C(c(o1)ccc1Br)=O

InChI

InChI=1S/C21H21BrN4O4/c1-14-18(20(28)23(2)21(29)26(14)15-6-4-3-5-7-15)24-10-12-25(13-11-24)19(27)16-8-9-17(22)30-16/h3-9H,10-13H2,1-2H3

InChI Key

JXSFXDPKQJRPHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961732

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.470

Distribution Coefficient, logD

2.470

Water Solubility, LogSw

-2.36

Polar Surface Area

59.946

Acid Dissociation Constant (pKa)

28.62

Base Dissociation Constant (pKb)

-0.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

F667-0481 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F667-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F667-0481?
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What is the minimum amount of F667-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F667-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F667-0481
  • 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 F667-0481 available by request