Y010-1180 Screening compound: 1'-(2,5-dichlorophenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

Y010-1180 Screening compound: 1'-(2,5-dichlorophenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Y010-1180 Screening compound: 1'-(2,5-dichlorophenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-1180
1'-(2,5-dichlorophenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

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

Y010-1180

Molecular Formula

C21H17Cl2N3O4 (C21 H17 Cl2 N3 O4)

Compound Name

1'-(2,5-dichlorophenyl)-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

IUPAC name

n/a

SMILES

O=C(C(C1)(C(COCC2)N2c2c1cccc2)C(N1c(cc(cc2)Cl)c2Cl)=O)NC1=O

InChI

InChI=1S/C21H17Cl2N3O4/c22-13-5-6-14(23)16(9-13)26-19(28)21(18(27)24-20(26)29)10-12-3-1-2-4-15(12)25-7-8-30-11-17(21)25/h1-6,9,17H,7-8,10-11H2,(H,24,27,29)

InChI Key

FWMBGTDTZQRUNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09992187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.29

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.290

Distribution Coefficient, logD

1.840

Water Solubility, LogSw

-3.56

Polar Surface Area

63.868

Acid Dissociation Constant (pKa)

5.97

Base Dissociation Constant (pKb)

2.34

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.60

Y010-1180 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y010-1180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-1180?
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What is the minimum amount of Y010-1180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-1180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-1180
  • 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 Y010-1180 available by request