3366-6087 Screening compound: methyl 2-[2-(3,4-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

3366-6087 Screening compound: methyl 2-[2-(3,4-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
3366-6087 Screening compound: methyl 2-[2-(3,4-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3366-6087
methyl 2-[2-(3,4-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-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

3366-6087

Molecular Formula

C28H25Cl2N3O4S (C28 H25 Cl2 N3 O4 S)

Compound Name

methyl 2-[2-(3,4-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

IUPAC name

methyl 2-[2-(34-dichlorophenyl)quinoline-4-amido]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

SMILES

CCN(CC)C(c1c(C)c(C(OC)=O)c(NC(c2cc(-c(cc3)cc(Cl)c3Cl)nc3ccccc23)=O)s1)=O

InChI

InChI=1S/C28H25Cl2N3O4S/c1-5-33(6-2)27(35)24-15(3)23(28(36)37-4)26(38-24)32-25(34)18-14-22(16-11-12-19(29)20(30)13-16)31-21-10-8-7-9-17(18)21/h7-14H,5-6H2,1-4H3,(H,32,34)

InChI Key

IDLXOHYGMSXGHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01356584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

570.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.597

Distribution Coefficient, logD

5.236

Water Solubility, LogSw

-6.33

Polar Surface Area

68.289

Acid Dissociation Constant (pKa)

6.06

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

3366-6087 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 3366-6087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3366-6087?
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What is the minimum amount of 3366-6087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3366-6087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3366-6087
  • 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 3366-6087 available by request