4181-2251 Screening compound: 5,7-dibromo-2-methylquinolin-8-yl N,N-diphenylcarbamate

4181-2251 Screening compound: 5,7-dibromo-2-methylquinolin-8-yl N,N-diphenylcarbamate
4181-2251 Screening compound: 5,7-dibromo-2-methylquinolin-8-yl N,N-diphenylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4181-2251
5,7-dibromo-2-methylquinolin-8-yl N,N-diphenylcarbamate

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

4181-2251

Molecular Formula

C23H16Br2N2O2 (C23 H16 Br2 N2 O2)

Compound Name

5,7-dibromo-2-methylquinolin-8-yl N,N-diphenylcarbamate

IUPAC name

57-dibromo-2-methylquinolin-8-yl NN-diphenylcarbamate

SMILES

Cc1ccc(c(Br)cc(Br)c2OC(N(c3ccccc3)c3ccccc3)=O)c2n1

InChI

InChI=1S/C23H16Br2N2O2/c1-15-12-13-18-19(24)14-20(25)22(21(18)26-15)29-23(28)27(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14H,1H3

InChI Key

SDTNDWSIYWWPLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02585206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.2

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.743

Distribution Coefficient, logD

6.742

Water Solubility, LogSw

-5.77

Polar Surface Area

30.138

Acid Dissociation Constant (pKa)

28.99

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 4181-2251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4181-2251?
Check Price and Availability of 4181-2251, 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 4181-2251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4181-2251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4181-2251
  • 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 4181-2251 available by request