V006-6843 Screening compound: N-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

V006-6843 Screening compound: N-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide
V006-6843 Screening compound: N-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-6843
N-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

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

V006-6843

Molecular Formula

C29H40N4O5S (C29 H40 N4 O5 S)

Compound Name

N-{2-[5-(2,5-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

IUPAC name

N-{2-[5-(25-dimethoxyphenyl)-3-(thiophen-2-yl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-33-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide

SMILES

CC(C)(C)CC(N(CCN1CCOCC1)CC(N(C(C1)c(cc(cc2)OC)c2OC)N=C1c1cccs1)=O)=O

InChI

InChI=1S/C29H40N4O5S/c1-29(2,3)19-27(34)32(11-10-31-12-14-38-15-13-31)20-28(35)33-24(18-23(30-33)26-7-6-16-39-26)22-17-21(36-4)8-9-25(22)37-5/h6-9,16-17,24H,10-15,18-20H2,1-5H3/t24-/m1/s1

InChI Key

WKYJAOHSKSCAON-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19800448

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

556.73

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.369

Distribution Coefficient, logD

4.342

Water Solubility, LogSw

-4.34

Polar Surface Area

70.604

Acid Dissociation Constant (pKa)

19.21

Base Dissociation Constant (pKb)

6.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.20

References: we are preparing a list of scientific research reports with V006-6843 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-6843?
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What is the minimum amount of V006-6843 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-6843
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-6843
  • 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 V006-6843 available by request