V013-8645 Screening compound: 5-(2,4-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide

V013-8645 Screening compound: 5-(2,4-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide
V013-8645 Screening compound: 5-(2,4-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-8645
5-(2,4-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-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

V013-8645

Molecular Formula

C17H21N3O3 (C17 H21 N3 O3)

Compound Name

5-(2,4-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide

IUPAC name

5-(24-dimethoxyphenyl)-1-ethyl-N-(prop-2-en-1-yl)-1H-pyrazole-3-carboxamide

SMILES

CCn(c(-c(ccc(OC)c1)c1OC)c1)nc1C(NCC=C)=O

InChI

InChI=1S/C17H21N3O3/c1-5-9-18-17(21)14-11-15(20(6-2)19-14)13-8-7-12(22-3)10-16(13)23-4/h5,7-8,10-11H,1,6,9H2,2-4H3,(H,18,21)

InChI Key

IWPLYWFJKVBFHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19966834

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

315.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.249

Distribution Coefficient, logD

2.249

Water Solubility, LogSw

-2.92

Polar Surface Area

52.622

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

-0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with V013-8645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-8645?
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What is the minimum amount of V013-8645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-8645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-8645
  • 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 V013-8645 available by request