V019-5762 Screening compound: 1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)urea

V019-5762 Screening compound: 1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)urea
V019-5762 Screening compound: 1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-5762
1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)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

V019-5762

Molecular Formula

C27H41N5O2 (C27 H41 N5 O2)

Compound Name

1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)urea

IUPAC name

1-{1-[2-(4-cycloheptylpiperazine-1-carbonyl)phenyl]piperidin-4-yl}-3-(prop-2-en-1-yl)urea

SMILES

C=CCNC(NC(CC1)CCN1c(cccc1)c1C(N(CC1)CCN1C1CCCCCC1)=O)=O

InChI

InChI=1S/C27H41N5O2/c1-2-15-28-27(34)29-22-13-16-31(17-14-22)25-12-8-7-11-24(25)26(33)32-20-18-30(19-21-32)23-9-5-3-4-6-10-23/h2,7-8,11-12,22-23H,1,3-6,9-10,13-21H2,(H2,28,29,34)

InChI Key

ZDNJKCCQOYCGQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19894897

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

467.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.277

Distribution Coefficient, logD

3.173

Water Solubility, LogSw

-3.79

Polar Surface Area

58.056

Acid Dissociation Constant (pKa)

15.43

Base Dissociation Constant (pKb)

6.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.00

V019-5762 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V019-5762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-5762?
Check Price and Availability of V019-5762, 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 V019-5762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-5762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-5762
  • 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 V019-5762 available by request