V014-5953 Screening compound: 2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

V014-5953 Screening compound: 2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide
V014-5953 Screening compound: 2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5953
2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)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

V014-5953

Molecular Formula

C27H33N3O3 (C27 H33 N3 O3)

Compound Name

2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

IUPAC name

2-[(3-methylphenyl)formamido]-2-[1-(3-phenylpropanoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

SMILES

Cc1cccc(C(NC(C(CC2)CCN2C(CCc2ccccc2)=O)C(NCC=C)=O)=O)c1

InChI

InChI=1S/C27H33N3O3/c1-3-16-28-27(33)25(29-26(32)23-11-7-8-20(2)19-23)22-14-17-30(18-15-22)24(31)13-12-21-9-5-4-6-10-21/h3-11,19,22,25H,1,12-18H2,2H3,(H,28,33)(H,29,32)/t25-/m0/s1

InChI Key

IUYHRILZNBRRGO-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19875309

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.403

Distribution Coefficient, logD

3.403

Water Solubility, LogSw

-3.74

Polar Surface Area

64.651

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

V014-5953 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V014-5953 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5953?
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What is the minimum amount of V014-5953 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5953
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5953
  • 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 V014-5953 available by request