V030-4905 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea

V030-4905 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea
V030-4905 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4905
1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea

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

V030-4905

Molecular Formula

C31H38FN7O3 (C31 H38 FN7 O3)

Compound Name

1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea

IUPAC name

1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-3-(4-methylphenyl)-1-[2-(morpholin-4-yl)ethyl]urea

SMILES

Cc(cc1)ccc1NC(N(CCN1CCOCC1)CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C31H38FN7O3/c1-24-3-9-27(10-4-24)33-31(41)39(16-15-36-19-21-42-22-20-36)23-30(40)38-14-2-13-37(17-18-38)29-12-11-28(34-35-29)25-5-7-26(32)8-6-25/h3-12H,2,13-23H2,1H3,(H,33,41)

InChI Key

QHXVRQUINZSQSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20500109

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

575.69

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.351

Distribution Coefficient, logD

2.995

Water Solubility, LogSw

-3.39

Polar Surface Area

77.787

Acid Dissociation Constant (pKa)

13.92

Base Dissociation Constant (pKb)

7.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.90

V030-4905 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V030-4905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4905?
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What is the minimum amount of V030-4905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4905
  • 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 V030-4905 available by request