V025-6148 Screening compound: 5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide

V025-6148 Screening compound: 5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide
V025-6148 Screening compound: 5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-6148
5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide

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

V025-6148

Molecular Formula

C31H34ClFN4O3 (C31 H34 ClFN4 O3)

Compound Name

5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide

IUPAC name

5-(4-chlorobenzamido)-N-[(4-fluorophenyl)methyl]-2-[4-(3-methylbutanoyl)-14-diazepan-1-yl]benzamide

SMILES

CC(C)CC(N(CCC1)CCN1c(ccc(NC(c(cc1)ccc1Cl)=O)c1)c1C(NCc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C31H34ClFN4O3/c1-21(2)18-29(38)37-15-3-14-36(16-17-37)28-13-12-26(35-30(39)23-6-8-24(32)9-7-23)19-27(28)31(40)34-20-22-4-10-25(33)11-5-22/h4-13,19,21H,3,14-18,20H2,1-2H3,(H,34,40)(H,35,39)

InChI Key

RXWHTDPCMOCKMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13268227

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

565.09

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.703

Distribution Coefficient, logD

5.701

Water Solubility, LogSw

-5.89

Polar Surface Area

67.426

Acid Dissociation Constant (pKa)

9.72

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.30

References: we are preparing a list of scientific research reports with V025-6148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-6148?
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What is the minimum amount of V025-6148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-6148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-6148
  • 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 V025-6148 available by request