Y020-2176 Screening compound: 2-(3-cyclohexyl-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl)-N-(2-methylphenyl)acetamide

Y020-2176 Screening compound: 2-(3-cyclohexyl-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl)-N-(2-methylphenyl)acetamide
Y020-2176 Screening compound: 2-(3-cyclohexyl-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl)-N-(2-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2176
2-(3-cyclohexyl-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl)-N-(2-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

Y020-2176

Molecular Formula

C25H29N3O5 (C25 H29 N3 O5)

Compound Name

2-(3-cyclohexyl-6,7-dimethoxy-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl)-N-(2-methylphenyl)acetamide

IUPAC name

2-(3-cyclohexyl-67-dimethoxy-24-dioxo-1234-tetrahydroquinazolin-1-yl)-N-(2-methylphenyl)acetamide

SMILES

Cc(cccc1)c1NC(CN(c(cc(c(OC)c1)OC)c1C(N1C2CCCCC2)=O)C1=O)=O

InChI

InChI=1S/C25H29N3O5/c1-16-9-7-8-12-19(16)26-23(29)15-27-20-14-22(33-3)21(32-2)13-18(20)24(30)28(25(27)31)17-10-5-4-6-11-17/h7-9,12-14,17H,4-6,10-11,15H2,1-3H3,(H,26,29)

InChI Key

AMTHPAFQZUVQPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08131563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.898

Distribution Coefficient, logD

3.898

Water Solubility, LogSw

-3.98

Polar Surface Area

68.201

Acid Dissociation Constant (pKa)

12.61

Base Dissociation Constant (pKb)

0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

Y020-2176 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 Y020-2176 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2176?
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What is the minimum amount of Y020-2176 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2176
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2176
  • 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 Y020-2176 available by request