C109-0659 Screening compound: 6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide

C109-0659 Screening compound: 6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
C109-0659 Screening compound: 6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C109-0659
6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-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

C109-0659

Molecular Formula

C25H24BrN3O4 (C25 H24 BrN3 O4)

Compound Name

6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide

IUPAC name

6-bromo-3-(4-ethylphenyl)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-oxo-1234-tetrahydroquinazoline-4-carboxamide

SMILES

CCc(cc1)ccc1N(C(C(NCc(cc1)ccc1OC)=O)(c(cc(cc1)Br)c1N1)O)C1=O

InChI

InChI=1S/C25H24BrN3O4/c1-3-16-4-9-19(10-5-16)29-24(31)28-22-13-8-18(26)14-21(22)25(29,32)23(30)27-15-17-6-11-20(33-2)12-7-17/h4-14,32H,3,15H2,1-2H3,(H,27,30)(H,28,31)/t25-/m1/s1

InChI Key

SPTWXZHACMABLC-RUZDIDTESA-N

MDL Number (MFCD)

MFCD14720211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.109

Distribution Coefficient, logD

5.109

Water Solubility, LogSw

-4.79

Polar Surface Area

74.649

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with C109-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C109-0659?
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What is the minimum amount of C109-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C109-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C109-0659
  • 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 C109-0659 available by request