C464-3153 Screening compound: ETHYL 2-{2-[3-(2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-SULFONAMIDO)PROPANAMIDO]-1,3-THIAZOL-4-YL}ACETATE

C464-3153 Screening compound: ETHYL 2-{2-[3-(2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-SULFONAMIDO)PROPANAMIDO]-1,3-THIAZOL-4-YL}ACETATE
C464-3153 Screening compound: ETHYL 2-{2-[3-(2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-SULFONAMIDO)PROPANAMIDO]-1,3-THIAZOL-4-YL}ACETATE alternative view

Chemical Structure Depiction of ChemDiv screening compound C464-3153
ETHYL 2-{2-[3-(2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-SULFONAMIDO)PROPANAMIDO]-1,3-THIAZOL-4-YL}ACETATE

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

C464-3153

Molecular Formula

C19H22N4O6S2 (C19 H22 N4 O6 S2)

Compound Name

ETHYL 2-{2-[3-(2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-SULFONAMIDO)PROPANAMIDO]-1,3-THIAZOL-4-YL}ACETATE

IUPAC name

n/a

SMILES

CCOC(Cc1csc(NC(CCNS(c(cc2)cc(CC3)c2NC3=O)(=O)=O)=O)n1)=O

InChI

InChI=1S/C19H22N4O6S2/c1-2-29-18(26)10-13-11-30-19(21-13)23-17(25)7-8-20-31(27,28)14-4-5-15-12(9-14)3-6-16(24)22-15/h4-5,9,11,20H,2-3,6-8,10H2,1H3,(H,22,24)(H,21,23,25)

InChI Key

NICIMVMYVSMGNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14760363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.478

Distribution Coefficient, logD

1.463

Water Solubility, LogSw

-2.57

Polar Surface Area

120.509

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.00

C464-3153 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C464-3153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C464-3153?
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What is the minimum amount of C464-3153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C464-3153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C464-3153
  • 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 C464-3153 available by request