V028-1081 Screening compound: 2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide

V028-1081 Screening compound: 2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide
V028-1081 Screening compound: 2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1081
2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide

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

V028-1081

Molecular Formula

C29H35N5O2 (C29 H35 N5 O2)

Compound Name

2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide

IUPAC name

2-methyl-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-14-diazepan-1-yl]ethyl}-N-(2-phenylethyl)propanamide

SMILES

CC(C)C(N(CCc1ccccc1)CC(N(CCC1)CCN1c(cc1)nnc1-c1ccccc1)=O)=O

InChI

InChI=1S/C29H35N5O2/c1-23(2)29(36)34(19-16-24-10-5-3-6-11-24)22-28(35)33-18-9-17-32(20-21-33)27-15-14-26(30-31-27)25-12-7-4-8-13-25/h3-8,10-15,23H,9,16-22H2,1-2H3

InChI Key

GPFCTVCCUMRKCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19835606

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

485.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.133

Distribution Coefficient, logD

4.127

Water Solubility, LogSw

-4.11

Polar Surface Area

57.347

Acid Dissociation Constant (pKa)

22.07

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

References: we are preparing a list of scientific research reports with V028-1081 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1081?
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What is the minimum amount of V028-1081 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1081
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1081
  • 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 V028-1081 available by request