V026-4737 Screening compound: 4-benzyl-2-(3,5-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

V026-4737 Screening compound: 4-benzyl-2-(3,5-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
V026-4737 Screening compound: 4-benzyl-2-(3,5-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4737
4-benzyl-2-(3,5-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-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

V026-4737

Molecular Formula

C25H29N5O4 (C25 H29 N5 O4)

Compound Name

4-benzyl-2-(3,5-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide

IUPAC name

4-benzyl-2-(35-dimethylphenyl)-N-[2-(morpholin-4-yl)ethyl]-35-dioxo-2345-tetrahydro-124-triazine-6-carboxamide

SMILES

Cc1cc(N(C(N2Cc3ccccc3)=O)N=C(C(NCCN3CCOCC3)=O)C2=O)cc(C)c1

InChI

InChI=1S/C25H29N5O4/c1-18-14-19(2)16-21(15-18)30-25(33)29(17-20-6-4-3-5-7-20)24(32)22(27-30)23(31)26-8-9-28-10-12-34-13-11-28/h3-7,14-16H,8-13,17H2,1-2H3,(H,26,31)

InChI Key

ROVSPBBHNAMPTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19840268

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

463.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.739

Distribution Coefficient, logD

2.708

Water Solubility, LogSw

-3.14

Polar Surface Area

78.391

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V026-4737 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4737?
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What is the minimum amount of V026-4737 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4737
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4737
  • 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 V026-4737 available by request