V014-0137 Screening compound: ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate

V014-0137 Screening compound: ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate
V014-0137 Screening compound: ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-0137
ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate

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

V014-0137

Molecular Formula

C23H29N7O3 (C23 H29 N7 O3)

Compound Name

ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]acetate

IUPAC name

ethyl 2-[5-methyl-7-(4-{[methyl(phenyl)carbamoyl]methyl}piperazin-1-yl)-[124]triazolo[15-a]pyrimidin-6-yl]acetate

SMILES

CCOC(Cc(c(C)nc1ncnn11)c1N1CCN(CC(N(C)c2ccccc2)=O)CC1)=O

InChI

InChI=1S/C23H29N7O3/c1-4-33-21(32)14-19-17(2)26-23-24-16-25-30(23)22(19)29-12-10-28(11-13-29)15-20(31)27(3)18-8-6-5-7-9-18/h5-9,16H,4,10-15H2,1-3H3

InChI Key

SGFPGUJFJFJKQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956904

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

451.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.169

Distribution Coefficient, logD

1.082

Water Solubility, LogSw

-1.87

Polar Surface Area

73.387

Acid Dissociation Constant (pKa)

12.53

Base Dissociation Constant (pKb)

6.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

V014-0137 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with V014-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-0137?
Check Price and Availability of V014-0137, 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 V014-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-0137
  • 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 V014-0137 available by request