Y020-3405 Screening compound: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5,6,7,8-tetrahydroquinazolin-5-one

Y020-3405 Screening compound: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5,6,7,8-tetrahydroquinazolin-5-one
Y020-3405 Screening compound: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5,6,7,8-tetrahydroquinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-3405
2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5,6,7,8-tetrahydroquinazolin-5-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

Y020-3405

Molecular Formula

C21H27N5O2 (C21 H27 N5 O2)

Compound Name

2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5,6,7,8-tetrahydroquinazolin-5-one

IUPAC name

2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-[(4-methylphenyl)amino]-5678-tetrahydroquinazolin-5-one

SMILES

Cc(cc1)ccc1Nc(nc(N1CCN(CCO)CC1)nc1CCC2)c1C2=O

InChI

InChI=1S/C21H27N5O2/c1-15-5-7-16(8-6-15)22-20-19-17(3-2-4-18(19)28)23-21(24-20)26-11-9-25(10-12-26)13-14-27/h5-8,27H,2-4,9-14H2,1H3,(H,22,23,24)

InChI Key

QNHSBEBSBMEKMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09785721

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.198

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-3.54

Polar Surface Area

65.856

Acid Dissociation Constant (pKa)

14.61

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

Y020-3405 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y020-3405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-3405?
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What is the minimum amount of Y020-3405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-3405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-3405
  • 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 Y020-3405 available by request