C614-0406 Screening compound: ethyl 2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]benzoate

C614-0406 Screening compound: ethyl 2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]benzoate
C614-0406 Screening compound: ethyl 2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-0406
ethyl 2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]benzoate

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

C614-0406

Molecular Formula

C22H24N2O2 (C22 H24 N2 O2)

Compound Name

ethyl 2-[(6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl)amino]benzoate

IUPAC name

ethyl 2-[(6-methyl-2349-tetrahydro-1H-carbazol-1-yl)amino]benzoate

SMILES

CCOC(c(cccc1)c1NC(CCC1)c2c1c(cc(C)cc1)c1[nH]2)=O

InChI

InChI=1S/C22H24N2O2/c1-3-26-22(25)16-7-4-5-9-18(16)23-20-10-6-8-15-17-13-14(2)11-12-19(17)24-21(15)20/h4-5,7,9,11-13,20,23-24H,3,6,8,10H2,1-2H3/t20-/m0/s1

InChI Key

HLPLEBVUYNDKKK-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD26965172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.398

Distribution Coefficient, logD

5.398

Water Solubility, LogSw

-5.50

Polar Surface Area

40.583

Acid Dissociation Constant (pKa)

15.00

Base Dissociation Constant (pKb)

1.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

C614-0406 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C614-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-0406?
Check Price and Availability of C614-0406, 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 C614-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-0406
  • 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 C614-0406 available by request