P035-0379 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-carboxamide

P035-0379 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-carboxamide
P035-0379 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P035-0379
N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-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

P035-0379

Molecular Formula

C19H17ClFN5O2 (C19 H17 ClFN5 O2)

Compound Name

N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-carboxamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-1-(5-propanamidopyridin-2-yl)-1H-imidazole-4-carboxamide

SMILES

CCC(Nc(cc1)cnc1-n1cnc(C(NCc(ccc(F)c2)c2Cl)=O)c1)=O

InChI

InChI=1S/C19H17ClFN5O2/c1-2-18(27)25-14-5-6-17(22-9-14)26-10-16(24-11-26)19(28)23-8-12-3-4-13(21)7-15(12)20/h3-7,9-11H,2,8H2,1H3,(H,23,28)(H,25,27)

InChI Key

ZRFNZEMECBUJMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559568

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.83

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.582

Distribution Coefficient, logD

3.581

Water Solubility, LogSw

-3.62

Polar Surface Area

68.640

Acid Dissociation Constant (pKa)

12.09

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

P035-0379 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P035-0379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P035-0379?
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What is the minimum amount of P035-0379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P035-0379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P035-0379
  • 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 P035-0379 available by request