6287-0072 Screening compound: 2-(2-propyl-1H-1,3-benzodiazole-1-carbonyl)benzoic acid

6287-0072 Screening compound: 2-(2-propyl-1H-1,3-benzodiazole-1-carbonyl)benzoic acid
6287-0072 Screening compound: 2-(2-propyl-1H-1,3-benzodiazole-1-carbonyl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6287-0072
2-(2-propyl-1H-1,3-benzodiazole-1-carbonyl)benzoic acid

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

6287-0072

Molecular Formula

C18H16N2O3 (C18 H16 N2 O3)

Compound Name

2-(2-propyl-1H-1,3-benzodiazole-1-carbonyl)benzoic acid

IUPAC name

2-(2-propyl-1H-13-benzodiazole-1-carbonyl)benzoic acid

SMILES

CCCc1nc(cccc2)c2n1C(c(cccc1)c1C(O)=O)=O

InChI

InChI=1S/C18H16N2O3/c1-2-7-16-19-14-10-5-6-11-15(14)20(16)17(21)12-8-3-4-9-13(12)18(22)23/h3-6,8-11H,2,7H2,1H3,(H,22,23)

InChI Key

VFIYVVZATALLAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02108606

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.151

Distribution Coefficient, logD

-2.629

Water Solubility, LogSw

-3.21

Polar Surface Area

53.491

Acid Dissociation Constant (pKa)

1.62

Base Dissociation Constant (pKb)

2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 6287-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6287-0072?
Check Price and Availability of 6287-0072, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6287-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6287-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6287-0072
  • 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 6287-0072 available by request