V022-4478 Screening compound: (3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine

V022-4478 Screening compound: (3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine
V022-4478 Screening compound: (3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-4478
(3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine

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

V022-4478

Molecular Formula

C29H38ClN3O4 (C29 H38 ClN3 O4)

Compound Name

(3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine

IUPAC name

(3-butoxy-2-hydroxypropyl)({[5-(2-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl})[(oxolan-2-yl)methyl]amine

SMILES

CCCCOCC(CN(CC1OCCC1)Cc(c(C)nn1-c2ccccc2)c1Oc(cccc1)c1Cl)O

InChI

InChI=1S/C29H38ClN3O4/c1-3-4-16-35-21-24(34)18-32(19-25-13-10-17-36-25)20-26-22(2)31-33(23-11-6-5-7-12-23)29(26)37-28-15-9-8-14-27(28)30/h5-9,11-12,14-15,24-25,34H,3-4,10,13,16-21H2,1-2H3

InChI Key

KOEYRDGQDCSGTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19883819

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

528.09

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.937

Distribution Coefficient, logD

4.572

Water Solubility, LogSw

-4.70

Polar Surface Area

58.345

Acid Dissociation Constant (pKa)

14.70

Base Dissociation Constant (pKb)

7.52

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

48.30

References: we are preparing a list of scientific research reports with V022-4478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-4478?
Check Price and Availability of V022-4478, 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 V022-4478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-4478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-4478
  • 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 V022-4478 available by request