V015-9188 Screening compound: N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazole-5-carboxamide

V015-9188 Screening compound: N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazole-5-carboxamide
V015-9188 Screening compound: N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-9188
N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazole-5-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

V015-9188

Molecular Formula

C38H49N3O2 (C38 H49 N3 O2)

Compound Name

N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(3,4-dimethylphenyl)-1-phenyl-1H-pyrazole-5-carboxamide

IUPAC name

N-{4-[24-bis(2-methylbutan-2-yl)phenoxy]butyl}-3-(34-dimethylphenyl)-1-phenyl-1H-pyrazole-5-carboxamide

SMILES

CCC(C)(C)c(cc1)cc(C(C)(C)CC)c1OCCCCNC(c1cc(-c2cc(C)c(C)cc2)nn1-c1ccccc1)=O

InChI

InChI=1S/C38H49N3O2/c1-9-37(5,6)30-20-21-35(32(25-30)38(7,8)10-2)43-23-15-14-22-39-36(42)34-26-33(29-19-18-27(3)28(4)24-29)40-41(34)31-16-12-11-13-17-31/h11-13,16-21,24-26H,9-10,14-15,22-23H2,1-8H3,(H,39,42)

InChI Key

CMIKMEXIPZQECJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19718528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

579.83

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

10.237

Distribution Coefficient, logD

10.237

Water Solubility, LogSw

-5.66

Polar Surface Area

44.821

Acid Dissociation Constant (pKa)

15.60

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with V015-9188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-9188?
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What is the minimum amount of V015-9188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-9188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-9188
  • 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 V015-9188 available by request