K288-0773 Screening compound: 3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

K288-0773 Screening compound: 3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one
K288-0773 Screening compound: 3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K288-0773
3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

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

K288-0773

Molecular Formula

C26H24N4O3S (C26 H24 N4 O3 S)

Compound Name

3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

3-{4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

COc(cccc1)c1N(CC1)CCN1C(c(cc1)ccc1N(C(c(cccc1)c1N1)=O)C1=S)=O

InChI

InChI=1S/C26H24N4O3S/c1-33-23-9-5-4-8-22(23)28-14-16-29(17-15-28)24(31)18-10-12-19(13-11-18)30-25(32)20-6-2-3-7-21(20)27-26(30)34/h2-13H,14-17H2,1H3,(H,27,34)

InChI Key

IJRXVHQOGNQEDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05023545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.416

Distribution Coefficient, logD

3.410

Water Solubility, LogSw

-3.87

Polar Surface Area

53.945

Acid Dissociation Constant (pKa)

9.27

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with K288-0773 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K288-0773?
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What is the minimum amount of K288-0773 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K288-0773
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K288-0773
  • 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 K288-0773 available by request