V007-4644 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-1-[2-(morpholin-4-yl)ethyl]-3-(propan-2-yl)urea

V007-4644 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-1-[2-(morpholin-4-yl)ethyl]-3-(propan-2-yl)urea
V007-4644 Screening compound: 1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-1-[2-(morpholin-4-yl)ethyl]-3-(propan-2-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-4644
1-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-1-[2-(morpholin-4-yl)ethyl]-3-(propan-2-yl)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

V007-4644

Molecular Formula

C27H38FN7O3 (C27 H38 FN7 O3)

Compound Name

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

IUPAC name

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

SMILES

CC(C)NC(N(CCN1CCOCC1)CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C27H38FN7O3/c1-21(2)29-27(37)35(13-12-32-16-18-38-19-17-32)20-26(36)34-11-3-10-33(14-15-34)25-9-8-24(30-31-25)22-4-6-23(28)7-5-22/h4-9,21H,3,10-20H2,1-2H3,(H,29,37)

InChI Key

ZXZWVRRVJFDCOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19834371

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

527.64

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

2.146

Distribution Coefficient, logD

1.396

Water Solubility, LogSw

-2.64

Polar Surface Area

78.355

Acid Dissociation Constant (pKa)

16.86

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

References: we are preparing a list of scientific research reports with V007-4644 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-4644?
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What is the minimum amount of V007-4644 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-4644
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-4644
  • 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 V007-4644 available by request