C301-7312 Screening compound: 3-chloro-N-(1,3,6-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)benzamide

C301-7312 Screening compound: 3-chloro-N-(1,3,6-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)benzamide
C301-7312 Screening compound: 3-chloro-N-(1,3,6-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-7312
3-chloro-N-(1,3,6-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)benzamide

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

C301-7312

Molecular Formula

C17H16ClN3O2 (C17 H16 ClN3 O2)

Compound Name

3-chloro-N-(1,3,6-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)benzamide

IUPAC name

3-chloro-N-(136-trimethyl-2-oxo-23-dihydro-1H-13-benzodiazol-5-yl)benzamide

SMILES

Cc(cc(c(N1C)c2)N(C)C1=O)c2NC(c1cccc(Cl)c1)=O

InChI

InChI=1S/C17H16ClN3O2/c1-10-7-14-15(21(3)17(23)20(14)2)9-13(10)19-16(22)11-5-4-6-12(18)8-11/h4-9H,1-3H3,(H,19,22)

InChI Key

OCOMSVDTKOJJFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14744883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.79

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.417

Distribution Coefficient, logD

3.406

Water Solubility, LogSw

-3.85

Polar Surface Area

40.316

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C301-7312 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C301-7312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-7312?
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What is the minimum amount of C301-7312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-7312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-7312
  • 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 C301-7312 available by request