C301-7760 Screening compound: 1-(5-chloro-2-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea

C301-7760 Screening compound: 1-(5-chloro-2-methylphenyl)-3-[1,3-dimethyl-2-oxo-6-(piperidin-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-5-yl]urea
C301-7760 Screening compound: 1-(5-chloro-2-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 C301-7760
1-(5-chloro-2-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

C301-7760

Molecular Formula

C22H26ClN5O2 (C22 H26 ClN5 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc(ccc(Cl)c1)c1NC(Nc(cc(c(N1C)c2)N(C)C1=O)c2N1CCCCC1)=O

InChI

InChI=1S/C22H26ClN5O2/c1-14-7-8-15(23)11-16(14)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

LUVSYTZLZYTLBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12129503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.93

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

4.789

Distribution Coefficient, logD

4.698

Water Solubility, LogSw

-4.78

Polar Surface Area

51.982

Acid Dissociation Constant (pKa)

8.22

Base Dissociation Constant (pKb)

6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

C301-7760 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C301-7760 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-7760?
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What is the minimum amount of C301-7760 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-7760
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-7760
  • 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 C301-7760 available by request