4347-7703 Screening compound: 2-[(ADAMANTAN-1-YL)FORMAMIDO]-N-(4,5-DIHYDRO-1,3-THIAZOL-2-YL)-3-METHYLBUTANAMIDE

4347-7703 Screening compound: 2-[(ADAMANTAN-1-YL)FORMAMIDO]-N-(4,5-DIHYDRO-1,3-THIAZOL-2-YL)-3-METHYLBUTANAMIDE
4347-7703 Screening compound: 2-[(ADAMANTAN-1-YL)FORMAMIDO]-N-(4,5-DIHYDRO-1,3-THIAZOL-2-YL)-3-METHYLBUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4347-7703
2-[(ADAMANTAN-1-YL)FORMAMIDO]-N-(4,5-DIHYDRO-1,3-THIAZOL-2-YL)-3-METHYLBUTANAMIDE

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

4347-7703

Molecular Formula

C19H29N3O2S (C19 H29 N3 O2 S)

Compound Name

2-[(ADAMANTAN-1-YL)FORMAMIDO]-N-(4,5-DIHYDRO-1,3-THIAZOL-2-YL)-3-METHYLBUTANAMIDE

IUPAC name

2-[(adamantan-1-yl)formamido]-N-(45-dihydro-13-thiazol-2-yl)-3-methylbutanamide

SMILES

CC(C)C(C(NC1=NCCS1)=O)NC(C1(CC(C2)C3)CC3CC2C1)=O

InChI

InChI=1S/C19H29N3O2S/c1-11(2)15(16(23)22-18-20-3-4-25-18)21-17(24)19-8-12-5-13(9-19)7-14(6-12)10-19/h11-15H,3-10H2,1-2H3,(H,21,24)(H,20,22,23)/t12?,13?,14?,15-,19?/m0/s1

InChI Key

BJVRTNTVXIZAOI-ZBUUCQELSA-N

MDL Number (MFCD)

MFCD03447402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.696

Distribution Coefficient, logD

3.696

Water Solubility, LogSw

-3.88

Polar Surface Area

56.847

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

84.20

4347-7703 in Drug Discovery

Included in Screening Libraries

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

GABA Library (7115 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4347-7703 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4347-7703?
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What is the minimum amount of 4347-7703 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4347-7703
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4347-7703
  • 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 4347-7703 available by request