V005-9260 Screening compound: 3-tert-butyl-1-{2-[3-(2,4-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea

V005-9260 Screening compound: 3-tert-butyl-1-{2-[3-(2,4-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea
V005-9260 Screening compound: 3-tert-butyl-1-{2-[3-(2,4-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9260
3-tert-butyl-1-{2-[3-(2,4-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea

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

V005-9260

Molecular Formula

C29H40N4O7 (C29 H40 N4 O7)

Compound Name

3-tert-butyl-1-{2-[3-(2,4-dimethoxyphenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea

IUPAC name

3-tert-butyl-1-{2-[3-(24-dimethoxyphenyl)-5-(34-dimethoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-(2-methoxyethyl)urea

SMILES

CC(C)(C)NC(N(CCOC)CC(N(C(C1)c(cc2)cc(OC)c2OC)N=C1c(ccc(OC)c1)c1OC)=O)=O

InChI

InChI=1S/C29H40N4O7/c1-29(2,3)30-28(35)32(13-14-36-4)18-27(34)33-23(19-9-12-24(38-6)26(15-19)40-8)17-22(31-33)21-11-10-20(37-5)16-25(21)39-7/h9-12,15-16,23H,13-14,17-18H2,1-8H3,(H,30,35)/t23-/m0/s1

InChI Key

ZKJULNDVUWNMGW-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19803717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

556.66

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.780

Distribution Coefficient, logD

3.780

Water Solubility, LogSw

-3.98

Polar Surface Area

91.064

Acid Dissociation Constant (pKa)

16.59

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.30

References: we are preparing a list of scientific research reports with V005-9260 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9260?
Check Price and Availability of V005-9260, 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 V005-9260 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9260
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9260
  • 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 V005-9260 available by request