4790-1174 Screening compound: ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate

4790-1174 Screening compound: ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate
4790-1174 Screening compound: ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4790-1174
ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate

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

4790-1174

Molecular Formula

C23H27N3O2 (C23 H27 N3 O2)

Compound Name

ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate

IUPAC name

ethyl 4-{[4-(diethylamino)phenyl]amino}-8-methylquinoline-3-carboxylate

SMILES

CCN(CC)c(cc1)ccc1Nc(c1cccc(C)c1nc1)c1C(OCC)=O

InChI

InChI=1S/C23H27N3O2/c1-5-26(6-2)18-13-11-17(12-14-18)25-22-19-10-8-9-16(4)21(19)24-15-20(22)23(27)28-7-3/h8-15H,5-7H2,1-4H3,(H,24,25)

InChI Key

HZBDKDROSHBMTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02730436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.331

Distribution Coefficient, logD

5.095

Water Solubility, LogSw

-5.42

Polar Surface Area

40.868

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

9.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

4790-1174 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4790-1174 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4790-1174?
Check Price and Availability of 4790-1174, 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 4790-1174 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4790-1174
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4790-1174
  • 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 4790-1174 available by request