V016-5653 Screening compound: 1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine

V016-5653 Screening compound: 1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine
V016-5653 Screening compound: 1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5653
1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine

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

V016-5653

Molecular Formula

C30H30ClN3O3 (C30 H30 ClN3 O3)

Compound Name

1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine

IUPAC name

1-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carbonyl]-4-(4-methoxyphenyl)piperazine

SMILES

Cc(n(c(-c(cc1)ccc1Cl)c1)-c(cc2)ccc2OC)c1C(N(CC1)CCN1c(cc1)ccc1OC)=O

InChI

InChI=1S/C30H30ClN3O3/c1-21-28(30(35)33-18-16-32(17-19-33)24-8-12-26(36-2)13-9-24)20-29(22-4-6-23(31)7-5-22)34(21)25-10-14-27(37-3)15-11-25/h4-15,20H,16-19H2,1-3H3

InChI Key

CQGLBMMCHBPQAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14246292

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

516.04

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.286

Distribution Coefficient, logD

6.286

Water Solubility, LogSw

-6.15

Polar Surface Area

36.657

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with V016-5653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5653?
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What is the minimum amount of V016-5653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5653
  • 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 V016-5653 available by request