3365-3181 Screening compound: propyl 2-[2-(2,4-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

3365-3181 Screening compound: propyl 2-[2-(2,4-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
3365-3181 Screening compound: propyl 2-[2-(2,4-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3365-3181
propyl 2-[2-(2,4-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-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

3365-3181

Molecular Formula

C30H28Cl2N2O3S (C30 H28 Cl2 N2 O3 S)

Compound Name

propyl 2-[2-(2,4-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

IUPAC name

propyl 2-[2-(24-dichlorophenyl)-3-methylquinoline-4-amido]-6-methyl-4567-tetrahydro-1-benzothiophene-3-carboxylate

SMILES

CCCOC(c1c(NC(c2c(C)c(-c(ccc(Cl)c3)c3Cl)nc3ccccc23)=O)sc2c1CCC(C)C2)=O

InChI

InChI=1S/C30H28Cl2N2O3S/c1-4-13-37-30(36)26-21-11-9-16(2)14-24(21)38-29(26)34-28(35)25-17(3)27(19-12-10-18(31)15-22(19)32)33-23-8-6-5-7-20(23)25/h5-8,10,12,15-16H,4,9,11,13-14H2,1-3H3,(H,34,35)/t16-/m1/s1

InChI Key

VYEIRLPKUPAELI-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD01350803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

567.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

8.760

Distribution Coefficient, logD

6.286

Water Solubility, LogSw

-6.74

Polar Surface Area

52.922

Acid Dissociation Constant (pKa)

4.93

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

3365-3181 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 3365-3181 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3365-3181?
Check Price and Availability of 3365-3181, 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 3365-3181 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3365-3181
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3365-3181
  • 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 3365-3181 available by request