C190-0020 Screening compound: N~7~-(3,4-dimethoxyphenethyl)-2,4-dioxo-3-pentyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide

C190-0020 Screening compound: N~7~-(3,4-dimethoxyphenethyl)-2,4-dioxo-3-pentyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide
C190-0020 Screening compound: N~7~-(3,4-dimethoxyphenethyl)-2,4-dioxo-3-pentyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C190-0020
N~7~-(3,4-dimethoxyphenethyl)-2,4-dioxo-3-pentyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide

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

C190-0020

Molecular Formula

C24H29N3O5 (C24 H29 N3 O5)

Compound Name

N~7~-(3,4-dimethoxyphenethyl)-2,4-dioxo-3-pentyl-1,2,3,4-tetrahydro-7-quinazolinecarboxamide

IUPAC name

n/a

SMILES

CCCCCN(C(c(ccc(C(NCCc(cc1)cc(OC)c1OC)=O)c1)c1N1)=O)C1=O

InChI

InChI=1S/C24H29N3O5/c1-4-5-6-13-27-23(29)18-9-8-17(15-19(18)26-24(27)30)22(28)25-12-11-16-7-10-20(31-2)21(14-16)32-3/h7-10,14-15H,4-6,11-13H2,1-3H3,(H,25,28)(H,26,30)

InChI Key

GUQHFSIHXYLSEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14724592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.469

Distribution Coefficient, logD

3.467

Water Solubility, LogSw

-3.59

Polar Surface Area

80.246

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

-3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

C190-0020 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C190-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C190-0020?
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What is the minimum amount of C190-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C190-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C190-0020
  • 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 C190-0020 available by request