V007-9751 Screening compound: (butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

V007-9751 Screening compound: (butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine
V007-9751 Screening compound: (butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-9751
(butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]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

V007-9751

Molecular Formula

C29H37N3O4 (C29 H37 N3 O4)

Compound Name

(butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

IUPAC name

(butan-2-yl)({[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl})[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amine

SMILES

CCC(C)N(CC(COCC#C)O)Cc(c(CC)nn1-c2ccccc2)c1Oc(cc1)ccc1OC

InChI

InChI=1S/C29H37N3O4/c1-6-18-35-21-24(33)19-31(22(4)7-2)20-27-28(8-3)30-32(23-12-10-9-11-13-23)29(27)36-26-16-14-25(34-5)15-17-26/h1,9-17,22,24,33H,7-8,18-21H2,2-5H3

InChI Key

IYCDYFMWWNABQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19884932

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

491.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.163

Distribution Coefficient, logD

3.544

Water Solubility, LogSw

-5.04

Polar Surface Area

57.329

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

9.01

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

41.40

V007-9751 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V007-9751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-9751?
Check Price and Availability of V007-9751, 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 V007-9751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-9751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-9751
  • 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 V007-9751 available by request