V020-1716 Screening compound: N~1~-{2-[3-(3-chlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]-5-methoxyphenyl}-2-methoxybenzamide

V020-1716 Screening compound: N~1~-{2-[3-(3-chlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]-5-methoxyphenyl}-2-methoxybenzamide
V020-1716 Screening compound: N~1~-{2-[3-(3-chlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]-5-methoxyphenyl}-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1716
N~1~-{2-[3-(3-chlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]-5-methoxyphenyl}-2-methoxybenzamide

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

V020-1716

Molecular Formula

C26H26ClN3O4 (C26 H26 ClN3 O4)

Compound Name

N~1~-{2-[3-(3-chlorobenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]-5-methoxyphenyl}-2-methoxybenzamide

IUPAC name

N-(2-{3-[(3-chlorophenyl)methyl]-2-oxo-13-diazinan-1-yl}-5-methoxyphenyl)-2-methoxybenzamide

SMILES

COc(cc1)cc(NC(c(cccc2)c2OC)=O)c1N(CCCN1Cc2cccc(Cl)c2)C1=O

InChI

InChI=1S/C26H26ClN3O4/c1-33-20-11-12-23(22(16-20)28-25(31)21-9-3-4-10-24(21)34-2)30-14-6-13-29(26(30)32)17-18-7-5-8-19(27)15-18/h3-5,7-12,15-16H,6,13-14,17H2,1-2H3,(H,28,31)

InChI Key

MHIQLWZNMOQXME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19931683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.966

Distribution Coefficient, logD

4.483

Water Solubility, LogSw

-4.94

Polar Surface Area

57.064

Acid Dissociation Constant (pKa)

7.09

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with V020-1716 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1716?
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What is the minimum amount of V020-1716 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1716
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1716
  • 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 V020-1716 available by request