V001-7180 Screening compound: N-[4-(4-CYCLOPENTANECARBONYLPIPERAZIN-1-YL)-3-(PYRROLIDINE-1-CARBONYL)PHENYL]-3-METHOXYBENZAMIDE

V001-7180 Screening compound: N-[4-(4-CYCLOPENTANECARBONYLPIPERAZIN-1-YL)-3-(PYRROLIDINE-1-CARBONYL)PHENYL]-3-METHOXYBENZAMIDE
V001-7180 Screening compound: N-[4-(4-CYCLOPENTANECARBONYLPIPERAZIN-1-YL)-3-(PYRROLIDINE-1-CARBONYL)PHENYL]-3-METHOXYBENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-7180
N-[4-(4-CYCLOPENTANECARBONYLPIPERAZIN-1-YL)-3-(PYRROLIDINE-1-CARBONYL)PHENYL]-3-METHOXYBENZAMIDE

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

V001-7180

Molecular Formula

C29H36N4O4 (C29 H36 N4 O4)

Compound Name

N-[4-(4-CYCLOPENTANECARBONYLPIPERAZIN-1-YL)-3-(PYRROLIDINE-1-CARBONYL)PHENYL]-3-METHOXYBENZAMIDE

IUPAC name

n/a

SMILES

COc1cccc(C(Nc(cc2)cc(C(N3CCCC3)=O)c2N(CC2)CCN2C(C2CCCC2)=O)=O)c1

InChI

InChI=1S/C29H36N4O4/c1-37-24-10-6-9-22(19-24)27(34)30-23-11-12-26(25(20-23)29(36)32-13-4-5-14-32)31-15-17-33(18-16-31)28(35)21-7-2-3-8-21/h6,9-12,19-21H,2-5,7-8,13-18H2,1H3,(H,30,34)

InChI Key

VOAXNLNYSREEDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14252960

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.169

Distribution Coefficient, logD

4.169

Water Solubility, LogSw

-4.24

Polar Surface Area

68.054

Acid Dissociation Constant (pKa)

11.98

Base Dissociation Constant (pKb)

6.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

V001-7180 in Drug Discovery

Included in Screening Libraries

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V001-7180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-7180?
Check Price and Availability of V001-7180, 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 V001-7180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-7180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-7180
  • 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 V001-7180 available by request