C109-1110 Screening compound: 6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide

C109-1110 Screening compound: 6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
C109-1110 Screening compound: 6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C109-1110
6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide

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

C109-1110

Molecular Formula

C23H28BrClN4O3 (C23 H28 BrClN4 O3)

Compound Name

6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide

IUPAC name

6-bromo-3-(4-chlorophenyl)-N-[3-(diethylamino)-2-methylpropyl]-4-hydroxy-2-oxo-1234-tetrahydroquinazoline-4-carboxamide

SMILES

CCN(CC)CC(C)CNC(C(c(cc(cc1)Br)c1N1)(N(c(cc2)ccc2Cl)C1=O)O)=O

InChI

InChI=1S/C23H28BrClN4O3/c1-4-28(5-2)14-15(3)13-26-21(30)23(32)19-12-16(24)6-11-20(19)27-22(31)29(23)18-9-7-17(25)8-10-18/h6-12,15,32H,4-5,13-14H2,1-3H3,(H,26,30)(H,27,31)

InChI Key

BEDAQSKMEABMHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14720329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.610

Distribution Coefficient, logD

1.812

Water Solubility, LogSw

-4.43

Polar Surface Area

70.809

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

10.20

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

C109-1110 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C109-1110 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C109-1110?
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What is the minimum amount of C109-1110 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C109-1110
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C109-1110
  • 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 C109-1110 available by request