V005-5032 Screening compound: 1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperidine

V005-5032 Screening compound: 1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperidine
V005-5032 Screening compound: 1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-5032
1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperidine

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

V005-5032

Molecular Formula

C28H31N5O5 (C28 H31 N5 O5)

Compound Name

1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl]-4-methylpiperidine

IUPAC name

1-[4-(4-methoxyphenoxy)-6-(4-methyl-3-nitrobenzoyl)-5H6H7H8H-pyrido[43-d]pyrimidin-2-yl]-4-methylpiperidine

SMILES

CC(CC1)CCN1c1nc(Oc(cc2)ccc2OC)c(CN(CC2)C(c3cc([N+]([O-])=O)c(C)cc3)=O)c2n1

InChI

InChI=1S/C28H31N5O5/c1-18-10-13-31(14-11-18)28-29-24-12-15-32(27(34)20-5-4-19(2)25(16-20)33(35)36)17-23(24)26(30-28)38-22-8-6-21(37-3)7-9-22/h4-9,16,18H,10-15,17H2,1-3H3

InChI Key

DUZQVUAPOCQOHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19934139

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

517.58

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.512

Distribution Coefficient, logD

5.512

Water Solubility, LogSw

-5.42

Polar Surface Area

87.130

Acid Dissociation Constant (pKa)

20.15

Base Dissociation Constant (pKb)

3.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.30

V005-5032 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V005-5032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-5032?
Check Price and Availability of V005-5032, 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 V005-5032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-5032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-5032
  • 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 V005-5032 available by request