V013-3515 Screening compound: N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide

V013-3515 Screening compound: N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide
V013-3515 Screening compound: N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-3515
N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide

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

V013-3515

Molecular Formula

C19H24N4O2S (C19 H24 N4 O2 S)

Compound Name

N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide

IUPAC name

N-{6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridin-3-yl}thiophene-2-carboxamide

SMILES

CC(C)CC(N(CC1)CCN1c(cc1)ncc1NC(c1cccs1)=O)=O

InChI

InChI=1S/C19H24N4O2S/c1-14(2)12-18(24)23-9-7-22(8-10-23)17-6-5-15(13-20-17)21-19(25)16-4-3-11-26-16/h3-6,11,13-14H,7-10,12H2,1-2H3,(H,21,25)

InChI Key

MKKFUPXLCDBAMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19898569

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

372.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.545

Distribution Coefficient, logD

3.544

Water Solubility, LogSw

-3.55

Polar Surface Area

52.602

Acid Dissociation Constant (pKa)

11.52

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

V013-3515 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with V013-3515 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-3515?
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What is the minimum amount of V013-3515 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-3515
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-3515
  • 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 V013-3515 available by request