C195-0008 Screening compound: 7,11-bis(3-nitrophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone

C195-0008 Screening compound: 7,11-bis(3-nitrophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone
C195-0008 Screening compound: 7,11-bis(3-nitrophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone alternative view

Chemical Structure Depiction of ChemDiv screening compound C195-0008
7,11-bis(3-nitrophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone

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

C195-0008

Molecular Formula

C19H14N6O8 (C19 H14 N6 O8)

Compound Name

7,11-bis(3-nitrophenyl)-2,4,8,10-tetraazaspiro[5.5]undecane-1,3,5,9-tetrone

IUPAC name

711-bis(3-nitrophenyl)-24810-tetraazaspiro[5.5]undecane-1359-tetrone

SMILES

[O-][N+](c1cccc(C(C(C(c2cccc([N+]([O-])=O)c2)N2)(C(NC(N3)=O)=O)C3=O)NC2=O)c1)=O

InChI

InChI=1S/C19H14N6O8/c26-15-19(16(27)23-18(29)22-15)13(9-3-1-5-11(7-9)24(30)31)20-17(28)21-14(19)10-4-2-6-12(8-10)25(32)33/h1-8,13-14H,(H2,20,21,28)(H2,22,23,26,27,29)

InChI Key

SMMMNTDCNCYPPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02716765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.36

Hydrogen Bond Acceptors Count

16.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

0.953

Distribution Coefficient, logD

0.643

Water Solubility, LogSw

-2.29

Polar Surface Area

165.920

Acid Dissociation Constant (pKa)

7.38

Base Dissociation Constant (pKb)

-4.90

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with C195-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C195-0008?
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What is the minimum amount of C195-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C195-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C195-0008
  • 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 C195-0008 available by request