V010-3013 Screening compound: 2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

V010-3013 Screening compound: 2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide
V010-3013 Screening compound: 2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-3013
2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

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

V010-3013

Molecular Formula

C27H33Cl2N3O2 (C27 H33 Cl2 N3 O2)

Compound Name

2-cyclopentyl-2-[4-(3,4-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

IUPAC name

2-cyclopentyl-2-[4-(34-dichlorobenzoyl)piperazin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide

SMILES

CC(C)c(cc1)ccc1NC(C(C1CCCC1)N(CC1)CCN1C(c(cc1)cc(Cl)c1Cl)=O)=O

InChI

InChI=1S/C27H33Cl2N3O2/c1-18(2)19-7-10-22(11-8-19)30-26(33)25(20-5-3-4-6-20)31-13-15-32(16-14-31)27(34)21-9-12-23(28)24(29)17-21/h7-12,17-18,20,25H,3-6,13-16H2,1-2H3,(H,30,33)/t25-/m0/s1

InChI Key

RMHYFHNYUXLENO-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19883046

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

502.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.859

Distribution Coefficient, logD

5.859

Water Solubility, LogSw

-6.16

Polar Surface Area

43.369

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

2.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.15

V010-3013 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V010-3013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-3013?
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What is the minimum amount of V010-3013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-3013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-3013
  • 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 V010-3013 available by request