V018-7670 Screening compound: 4-BENZYL-2-(4-METHOXYPHENYL)-6-(PYRROLIDINE-1-CARBONYL)-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-3,5-DIONE

V018-7670 Screening compound: 4-BENZYL-2-(4-METHOXYPHENYL)-6-(PYRROLIDINE-1-CARBONYL)-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-3,5-DIONE
V018-7670 Screening compound: 4-BENZYL-2-(4-METHOXYPHENYL)-6-(PYRROLIDINE-1-CARBONYL)-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-3,5-DIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-7670
4-BENZYL-2-(4-METHOXYPHENYL)-6-(PYRROLIDINE-1-CARBONYL)-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-3,5-DIONE

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

V018-7670

Molecular Formula

C22H22N4O4 (C22 H22 N4 O4)

Compound Name

4-BENZYL-2-(4-METHOXYPHENYL)-6-(PYRROLIDINE-1-CARBONYL)-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-3,5-DIONE

IUPAC name

4-benzyl-2-(4-methoxyphenyl)-6-(pyrrolidine-1-carbonyl)-2345-tetrahydro-124-triazine-35-dione

SMILES

COc(cc1)ccc1N(C(N1Cc2ccccc2)=O)N=C(C(N2CCCC2)=O)C1=O

InChI

InChI=1S/C22H22N4O4/c1-30-18-11-9-17(10-12-18)26-22(29)25(15-16-7-3-2-4-8-16)21(28)19(23-26)20(27)24-13-5-6-14-24/h2-4,7-12H,5-6,13-15H2,1H3

InChI Key

GZYCNEROJUUBMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19834570

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.932

Distribution Coefficient, logD

2.932

Water Solubility, LogSw

-3.30

Polar Surface Area

66.803

Acid Dissociation Constant (pKa)

27.85

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

References: we are preparing a list of scientific research reports with V018-7670 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-7670?
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What is the minimum amount of V018-7670 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-7670
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-7670
  • 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 V018-7670 available by request