V021-6251 Screening compound: N-(6-{4-[2-(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-3-pyridyl)-N'-(3-fluoro-4-methylphenyl)urea

V021-6251 Screening compound: N-(6-{4-[2-(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-3-pyridyl)-N'-(3-fluoro-4-methylphenyl)urea
V021-6251 Screening compound: N-(6-{4-[2-(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-3-pyridyl)-N'-(3-fluoro-4-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6251
N-(6-{4-[2-(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-3-pyridyl)-N'-(3-fluoro-4-methylphenyl)urea

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

V021-6251

Molecular Formula

C26H27ClFN5O3 (C26 H27 ClFN5 O3)

Compound Name

N-(6-{4-[2-(4-chlorophenoxy)acetyl]-1,4-diazepan-1-yl}-3-pyridyl)-N'-(3-fluoro-4-methylphenyl)urea

IUPAC name

n/a

SMILES

Cc(ccc(NC(Nc(cc1)cnc1N(CCC1)CCN1C(COc(cc1)ccc1Cl)=O)=O)c1)c1F

InChI

InChI=1S/C26H27ClFN5O3/c1-18-3-6-20(15-23(18)28)30-26(35)31-21-7-10-24(29-16-21)32-11-2-12-33(14-13-32)25(34)17-36-22-8-4-19(27)5-9-22/h3-10,15-16H,2,11-14,17H2,1H3,(H2,30,31,35)

InChI Key

FDCVKHZQLILZMY-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.615

Distribution Coefficient, logD

5.615

Water Solubility, LogSw

-5.89

Polar Surface Area

68.354

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

8.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

V021-6251 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V021-6251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6251?
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What is the minimum amount of V021-6251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6251
  • 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 V021-6251 available by request