V030-9258 Screening compound: 3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

V030-9258 Screening compound: 3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide
V030-9258 Screening compound: 3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-9258
3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

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

V030-9258

Molecular Formula

C19H26N4O4 (C19 H26 N4 O4)

Compound Name

3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

IUPAC name

3-methyl-8-nitro-N-[(oxolan-2-yl)methyl]-1H2H3H4H4aH5H6H-pyrazino[12-a]quinoline-5-carboxamide

SMILES

CN(CC1)CC(C(C2)C(NCC3OCCC3)=O)N1c(cc1)c2cc1[N+]([O-])=O

InChI

InChI=1S/C19H26N4O4/c1-21-6-7-22-17-5-4-14(23(25)26)9-13(17)10-16(18(22)12-21)19(24)20-11-15-3-2-8-27-15/h4-5,9,15-16,18H,2-3,6-8,10-12H2,1H3,(H,20,24)

InChI Key

FRJORIPIMKZPGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19853070

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

374.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.130

Distribution Coefficient, logD

-0.743

Water Solubility, LogSw

-2.42

Polar Surface Area

72.469

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

9.27

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

63.20

V030-9258 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V030-9258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-9258?
Check Price and Availability of V030-9258, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V030-9258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-9258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-9258
  • 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 V030-9258 available by request