C301-7767 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea

C301-7767 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea
C301-7767 Screening compound: 1-(4-bromo-3-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-7767
1-(4-bromo-3-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-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

C301-7767

Molecular Formula

C22H26BrN5O2 (C22 H26 BrN5 O2)

Compound Name

1-(4-bromo-3-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea

IUPAC name

1-(4-bromo-3-methylphenyl)-3-[13-dimethyl-2-oxo-6-(piperidin-1-yl)-23-dihydro-1H-13-benzodiazol-5-yl]urea

SMILES

Cc(cc(cc1)NC(Nc(cc(c(N2C)c3)N(C)C2=O)c3N2CCCCC2)=O)c1Br

InChI

InChI=1S/C22H26BrN5O2/c1-14-11-15(7-8-16(14)23)24-21(29)25-17-12-19-20(27(3)22(30)26(19)2)13-18(17)28-9-5-4-6-10-28/h7-8,11-13H,4-6,9-10H2,1-3H3,(H2,24,25,29)

InChI Key

YICWONDOFPCSEG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12129509

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.505

Distribution Coefficient, logD

5.476

Water Solubility, LogSw

-5.27

Polar Surface Area

52.680

Acid Dissociation Constant (pKa)

10.42

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

C301-7767 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C301-7767 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-7767?
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What is the minimum amount of C301-7767 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-7767
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-7767
  • 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 C301-7767 available by request