V018-4943 Screening compound: 1-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)urea

V018-4943 Screening compound: 1-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)urea
V018-4943 Screening compound: 1-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-4943
1-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)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

V018-4943

Molecular Formula

C25H26N4O3 (C25 H26 N4 O3)

Compound Name

1-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)urea

IUPAC name

1-[4-(3-benzyl-2-oxo-13-diazinan-1-yl)phenyl]-3-(3-methoxyphenyl)urea

SMILES

COc1cccc(NC(Nc(cc2)ccc2N(CCCN2Cc3ccccc3)C2=O)=O)c1

InChI

InChI=1S/C25H26N4O3/c1-32-23-10-5-9-21(17-23)27-24(30)26-20-11-13-22(14-12-20)29-16-6-15-28(25(29)31)18-19-7-3-2-4-8-19/h2-5,7-14,17H,6,15-16,18H2,1H3,(H2,26,27,30)

InChI Key

JUWOWSDBKZXYEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19930803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.965

Distribution Coefficient, logD

4.965

Water Solubility, LogSw

-4.64

Polar Surface Area

59.644

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

V018-4943 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 V018-4943 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-4943?
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What is the minimum amount of V018-4943 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-4943
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-4943
  • 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 V018-4943 available by request