V023-5297 Screening compound: N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

V023-5297 Screening compound: N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
V023-5297 Screening compound: N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-5297
N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)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

V023-5297

Molecular Formula

C33H34FN5O4 (C33 H34 FN5 O4)

Compound Name

N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

IUPAC name

N-[(4-fluorophenyl)methyl]-3-methoxy-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)benzamide

SMILES

COc1cccc(C(N(CC(N(CCC2)CCN2c(cc2)nnc2-c2cc(OC)ccc2)=O)Cc(cc2)ccc2F)=O)c1

InChI

InChI=1S/C33H34FN5O4/c1-42-28-8-3-6-25(20-28)30-14-15-31(36-35-30)37-16-5-17-38(19-18-37)32(40)23-39(22-24-10-12-27(34)13-11-24)33(41)26-7-4-9-29(21-26)43-2/h3-4,6-15,20-21H,5,16-19,22-23H2,1-2H3

InChI Key

CMPLKBYIVYTBOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19833860

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

583.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.270

Distribution Coefficient, logD

4.100

Water Solubility, LogSw

-4.40

Polar Surface Area

72.184

Acid Dissociation Constant (pKa)

22.66

Base Dissociation Constant (pKb)

7.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with V023-5297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-5297?
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What is the minimum amount of V023-5297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-5297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-5297
  • 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 V023-5297 available by request