V007-0891 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide

V007-0891 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide
V007-0891 Screening compound: N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-0891
N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide

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

V007-0891

Molecular Formula

C30H25FN4O3 (C30 H25 FN4 O3)

Compound Name

N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl}phenyl)-4-methylbenzamide

IUPAC name

N-(4-{3-[(4-fluorophenyl)methoxy]-5-(4-methoxyphenyl)-1H-124-triazol-1-yl}phenyl)-4-methylbenzamide

SMILES

Cc(cc1)ccc1C(Nc(cc1)ccc1-n(c(-c(cc1)ccc1OC)n1)nc1OCc(cc1)ccc1F)=O

InChI

InChI=1S/C30H25FN4O3/c1-20-3-7-23(8-4-20)29(36)32-25-13-15-26(16-14-25)35-28(22-9-17-27(37-2)18-10-22)33-30(34-35)38-19-21-5-11-24(31)12-6-21/h3-18H,19H2,1-2H3,(H,32,36)

InChI Key

LDEGHYUOOYBBDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19780631

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

508.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.745

Distribution Coefficient, logD

6.745

Water Solubility, LogSw

-5.76

Polar Surface Area

61.553

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with V007-0891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-0891?
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What is the minimum amount of V007-0891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-0891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-0891
  • 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 V007-0891 available by request