G373-3339 Screening compound: 3-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}-1-(naphthalen-2-yl)urea

G373-3339 Screening compound: 3-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}-1-(naphthalen-2-yl)urea
G373-3339 Screening compound: 3-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}-1-(naphthalen-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G373-3339
3-{2-[2-(4-methylphenyl)-1H-1,3-benzodiazol-1-yl]ethyl}-1-(naphthalen-2-yl)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

G373-3339

Molecular Formula

C27H24N4O (C27 H24 N4 O)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1-c1nc(cccc2)c2n1CCNC(Nc1cc2ccccc2cc1)=O

InChI

InChI=1S/C27H24N4O/c1-19-10-12-21(13-11-19)26-30-24-8-4-5-9-25(24)31(26)17-16-28-27(32)29-23-15-14-20-6-2-3-7-22(20)18-23/h2-15,18H,16-17H2,1H3,(H2,28,29,32)

InChI Key

NQKNCORECITORW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15006389

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.729

Distribution Coefficient, logD

6.724

Water Solubility, LogSw

-6.43

Polar Surface Area

43.341

Acid Dissociation Constant (pKa)

13.25

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

G373-3339 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G373-3339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G373-3339?
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What is the minimum amount of G373-3339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G373-3339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G373-3339
  • 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 G373-3339 available by request