3470-5695 Screening compound: 2-cyclopentyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-phenylacetamide

3470-5695 Screening compound: 2-cyclopentyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-phenylacetamide
3470-5695 Screening compound: 2-cyclopentyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3470-5695
2-cyclopentyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-phenylacetamide

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

3470-5695

Molecular Formula

C29H29N3O4 (C29 H29 N3 O4)

Compound Name

2-cyclopentyl-N-[2-(3,4-dimethoxyphenyl)-4-oxo-3,4-dihydroquinazolin-3-yl]-2-phenylacetamide

IUPAC name

2-cyclopentyl-N-[2-(34-dimethoxyphenyl)-4-oxo-34-dihydroquinazolin-3-yl]-2-phenylacetamide

SMILES

COc(ccc(C(N1NC(C(C2CCCC2)c2ccccc2)=O)=Nc(cccc2)c2C1=O)c1)c1OC

InChI

InChI=1S/C29H29N3O4/c1-35-24-17-16-21(18-25(24)36-2)27-30-23-15-9-8-14-22(23)29(34)32(27)31-28(33)26(20-12-6-7-13-20)19-10-4-3-5-11-19/h3-5,8-11,14-18,20,26H,6-7,12-13H2,1-2H3,(H,31,33)/t26-/m0/s1

InChI Key

LRFLUWQVWLGNQO-SANMLTNESA-N

MDL Number (MFCD)

MFCD02642997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.909

Distribution Coefficient, logD

3.908

Water Solubility, LogSw

-4.07

Polar Surface Area

67.298

Acid Dissociation Constant (pKa)

9.99

Base Dissociation Constant (pKb)

1.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.60

3470-5695 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 3470-5695 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3470-5695?
Check Price and Availability of 3470-5695, 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 3470-5695 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3470-5695
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3470-5695
  • 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 3470-5695 available by request