V013-8915 Screening compound: N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide

V013-8915 Screening compound: N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide
V013-8915 Screening compound: N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-8915
N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide

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

V013-8915

Molecular Formula

C27H27FN2O3 (C27 H27 FN2 O3)

Compound Name

N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide

IUPAC name

N-(3-{[(cyclopropylmethyl)carbamoyl]methyl}phenyl)-N-[(4-fluorophenyl)methyl]-3-methoxybenzamide

SMILES

COc1cccc(C(N(Cc(cc2)ccc2F)c2cc(CC(NCC3CC3)=O)ccc2)=O)c1

InChI

InChI=1S/C27H27FN2O3/c1-33-25-7-3-5-22(16-25)27(32)30(18-20-10-12-23(28)13-11-20)24-6-2-4-21(14-24)15-26(31)29-17-19-8-9-19/h2-7,10-14,16,19H,8-9,15,17-18H2,1H3,(H,29,31)

InChI Key

WCNPBZZOXQIQDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19915613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.382

Distribution Coefficient, logD

4.382

Water Solubility, LogSw

-4.48

Polar Surface Area

47.856

Acid Dissociation Constant (pKa)

15.49

Base Dissociation Constant (pKb)

5.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with V013-8915 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-8915?
Check Price and Availability of V013-8915, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V013-8915 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-8915
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-8915
  • 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 V013-8915 available by request