C200-6456 Screening compound: 5-{1-[(butylcarbamoyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide

C200-6456 Screening compound: 5-{1-[(butylcarbamoyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide
C200-6456 Screening compound: 5-{1-[(butylcarbamoyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-6456
5-{1-[(butylcarbamoyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide

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

C200-6456

Molecular Formula

C22H32N4O4 (C22 H32 N4 O4)

Compound Name

5-{1-[(butylcarbamoyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide

IUPAC name

5-{1-[(butylcarbamoyl)methyl]-24-dioxo-1234-tetrahydroquinazolin-3-yl}-N-(propan-2-yl)pentanamide

SMILES

CCCCNC(CN(c(cccc1)c1C(N1CCCCC(NC(C)C)=O)=O)C1=O)=O

InChI

InChI=1S/C22H32N4O4/c1-4-5-13-23-20(28)15-26-18-11-7-6-10-17(18)21(29)25(22(26)30)14-9-8-12-19(27)24-16(2)3/h6-7,10-11,16H,4-5,8-9,12-15H2,1-3H3,(H,23,28)(H,24,27)

InChI Key

LBYQHHNKSGRQPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26961884

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.618

Distribution Coefficient, logD

1.618

Water Solubility, LogSw

-2.69

Polar Surface Area

79.547

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

C200-6456 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C200-6456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-6456?
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What is the minimum amount of C200-6456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-6456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-6456
  • 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 C200-6456 available by request