L361-1681 Screening compound: 3-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-1-(4-methylphenyl)urea

L361-1681 Screening compound: 3-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-1-(4-methylphenyl)urea
L361-1681 Screening compound: 3-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-1-(4-methylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L361-1681
3-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-1-(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

L361-1681

Molecular Formula

C23H22N4O (C23 H22 N4 O)

Compound Name

3-{2-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-1-(4-methylphenyl)urea

IUPAC name

3-{2-[2-(1H-13-benzodiazol-2-yl)ethyl]phenyl}-1-(4-methylphenyl)urea

SMILES

Cc(cc1)ccc1NC(Nc1c(CCc2nc(cccc3)c3[nH]2)cccc1)=O

InChI

InChI=1S/C23H22N4O/c1-16-10-13-18(14-11-16)24-23(28)27-19-7-3-2-6-17(19)12-15-22-25-20-8-4-5-9-21(20)26-22/h2-11,13-14H,12,15H2,1H3,(H,25,26)(H2,24,27,28)

InChI Key

XNCGYWFJBFOAAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15124906

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.745

Distribution Coefficient, logD

5.685

Water Solubility, LogSw

-5.47

Polar Surface Area

51.854

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

L361-1681 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anticancer Library (62698 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with L361-1681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L361-1681?
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What is the minimum amount of L361-1681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L361-1681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L361-1681
  • 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 L361-1681 available by request