V002-8343 Screening compound: benzyl N-{3-[3-(3-methoxybenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}carbamate

V002-8343 Screening compound: benzyl N-{3-[3-(3-methoxybenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}carbamate
V002-8343 Screening compound: benzyl N-{3-[3-(3-methoxybenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-8343
benzyl N-{3-[3-(3-methoxybenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}carbamate

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

V002-8343

Molecular Formula

C26H27N3O4 (C26 H27 N3 O4)

Compound Name

benzyl N-{3-[3-(3-methoxybenzyl)-2-oxotetrahydro-1(2H)-pyrimidinyl]phenyl}carbamate

IUPAC name

benzyl N-(3-{3-[(3-methoxyphenyl)methyl]-2-oxo-13-diazinan-1-yl}phenyl)carbamate

SMILES

COc1cccc(CN(CCCN2c3cc(NC(OCc4ccccc4)=O)ccc3)C2=O)c1

InChI

InChI=1S/C26H27N3O4/c1-32-24-13-5-10-21(16-24)18-28-14-7-15-29(26(28)31)23-12-6-11-22(17-23)27-25(30)33-19-20-8-3-2-4-9-20/h2-6,8-13,16-17H,7,14-15,18-19H2,1H3,(H,27,30)

InChI Key

YLLMZTQERALFLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19897163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.253

Distribution Coefficient, logD

5.253

Water Solubility, LogSw

-5.11

Polar Surface Area

58.888

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.08

References: we are preparing a list of scientific research reports with V002-8343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-8343?
Check Price and Availability of V002-8343, 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 V002-8343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-8343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-8343
  • 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 V002-8343 available by request