8211-0197 Screening compound: N-[7-(4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]-2-methylbutanamide

8211-0197 Screening compound: N-[7-(4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]-2-methylbutanamide
8211-0197 Screening compound: N-[7-(4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]-2-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8211-0197
N-[7-(4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]-2-methylbutanamide

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

8211-0197

Molecular Formula

C20H23N3O3 (C20 H23 N3 O3)

Compound Name

N-[7-(4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl]-2-methylbutanamide

IUPAC name

N-[7-(4-methoxyphenyl)-5-oxo-5678-tetrahydroquinazolin-2-yl]-2-methylbutanamide

SMILES

CCC(C)C(Nc(nc1)nc(CC(C2)c(cc3)ccc3OC)c1C2=O)=O

InChI

InChI=1S/C20H23N3O3/c1-4-12(2)19(25)23-20-21-11-16-17(22-20)9-14(10-18(16)24)13-5-7-15(26-3)8-6-13/h5-8,11-12,14H,4,9-10H2,1-3H3,(H,21,22,23,25)

InChI Key

GBURHAOAYDTAPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05690255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.404

Distribution Coefficient, logD

3.127

Water Solubility, LogSw

-3.53

Polar Surface Area

65.770

Acid Dissociation Constant (pKa)

7.45

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

8211-0197 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8211-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8211-0197?
Check Price and Availability of 8211-0197, 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 8211-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8211-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8211-0197
  • 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 8211-0197 available by request