V013-2353 Screening compound: N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide

V013-2353 Screening compound: N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide
V013-2353 Screening compound: N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-2353
N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide

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

V013-2353

Molecular Formula

C23H32N2O2S (C23 H32 N2 O2 S)

Compound Name

N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide

IUPAC name

N-({benzyl[(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-butyl-2-methylpropanamide

SMILES

CCCCN(CC(N(Cc1ccc(C)s1)Cc1ccccc1)=O)C(C(C)C)=O

InChI

InChI=1S/C23H32N2O2S/c1-5-6-14-24(23(27)18(2)3)17-22(26)25(15-20-10-8-7-9-11-20)16-21-13-12-19(4)28-21/h7-13,18H,5-6,14-17H2,1-4H3

InChI Key

ITVCJXSJYMESLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19766263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.888

Distribution Coefficient, logD

4.888

Water Solubility, LogSw

-4.40

Polar Surface Area

33.401

Acid Dissociation Constant (pKa)

22.33

Base Dissociation Constant (pKb)

-0.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

V013-2353 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 V013-2353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-2353?
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What is the minimum amount of V013-2353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-2353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-2353
  • 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 V013-2353 available by request