C660-0062 Screening compound: N-(2,2-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

C660-0062 Screening compound: N-(2,2-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide
C660-0062 Screening compound: N-(2,2-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0062
N-(2,2-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

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

C660-0062

Molecular Formula

C17H18FN3O3S (C17 H18 FN3 O3 S)

Compound Name

N-(2,2-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[2,3-c]pyrazole-5-carboxamide

IUPAC name

N-(22-dimethoxyethyl)-3-(2-fluorophenyl)-1-methyl-1H-thieno[23-c]pyrazole-5-carboxamide

SMILES

Cn(c1c2cc(C(NCC(OC)OC)=O)s1)nc2-c(cccc1)c1F

InChI

InChI=1S/C17H18FN3O3S/c1-21-17-11(15(20-21)10-6-4-5-7-12(10)18)8-13(25-17)16(22)19-9-14(23-2)24-3/h4-8,14H,9H2,1-3H3,(H,19,22)

InChI Key

UDASNNMHTJJACB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14779870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.919

Distribution Coefficient, logD

1.919

Water Solubility, LogSw

-2.90

Polar Surface Area

55.536

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

C660-0062 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C660-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0062?
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What is the minimum amount of C660-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0062
  • 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 C660-0062 available by request