V020-5459 Screening compound: N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide

V020-5459 Screening compound: N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide
V020-5459 Screening compound: N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-5459
N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide

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

V020-5459

Molecular Formula

C25H25ClN4O3 (C25 H25 ClN4 O3)

Compound Name

N-{6-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide

IUPAC name

N-{6-[4-(2-chlorobenzoyl)-14-diazepan-1-yl]pyridin-3-yl}-2-phenoxyacetamide

SMILES

O=C(COc1ccccc1)Nc(cc1)cnc1N(CCC1)CCN1C(c(cccc1)c1Cl)=O

InChI

InChI=1S/C25H25ClN4O3/c26-22-10-5-4-9-21(22)25(32)30-14-6-13-29(15-16-30)23-12-11-19(17-27-23)28-24(31)18-33-20-7-2-1-3-8-20/h1-5,7-12,17H,6,13-16,18H2,(H,28,31)

InChI Key

NNLNEICWFSFBSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19911629

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

464.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.359

Distribution Coefficient, logD

4.358

Water Solubility, LogSw

-4.49

Polar Surface Area

59.456

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with V020-5459 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-5459?
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What is the minimum amount of V020-5459 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-5459
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-5459
  • 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 V020-5459 available by request