Y010-1098 Screening compound: 9'-chloro-1,5-dimethyl-3'-phenyl-1',2',3',4',4'a,6'-hexahydrospiro[1,5-diazinane-3,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione

Y010-1098 Screening compound: 9'-chloro-1,5-dimethyl-3'-phenyl-1',2',3',4',4'a,6'-hexahydrospiro[1,5-diazinane-3,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione
Y010-1098 Screening compound: 9'-chloro-1,5-dimethyl-3'-phenyl-1',2',3',4',4'a,6'-hexahydrospiro[1,5-diazinane-3,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-1098
9'-chloro-1,5-dimethyl-3'-phenyl-1',2',3',4',4'a,6'-hexahydrospiro[1,5-diazinane-3,5'-pyrazino[1,2-a]quinoline]-2,4,6-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

Y010-1098

Molecular Formula

C23H23ClN4O3 (C23 H23 ClN4 O3)

Compound Name

9'-chloro-1,5-dimethyl-3'-phenyl-1',2',3',4',4'a,6'-hexahydrospiro[1,5-diazinane-3,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione

IUPAC name

9'-chloro-15-dimethyl-3'-phenyl-1'2'3'4'4'a6'-hexahydrospiro[15-diazinane-35'-pyrazino[12-a]quinoline]-246-trione

SMILES

CN(C(C(C1)(C(CN(CC2)c3ccccc3)N2c2c1ccc(Cl)c2)C(N1C)=O)=O)C1=O

InChI

InChI=1S/C23H23ClN4O3/c1-25-20(29)23(21(30)26(2)22(25)31)13-15-8-9-16(24)12-18(15)28-11-10-27(14-19(23)28)17-6-4-3-5-7-17/h3-9,12,19H,10-11,13-14H2,1-2H3/t19-/m0/s1

InChI Key

KYJQXUSOYBKPOD-IBGZPJMESA-N

MDL Number (MFCD)

MFCD07756213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.107

Distribution Coefficient, logD

4.106

Water Solubility, LogSw

-4.38

Polar Surface Area

50.691

Acid Dissociation Constant (pKa)

23.31

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with Y010-1098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-1098?
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What is the minimum amount of Y010-1098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-1098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-1098
  • 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 Y010-1098 available by request