V008-6505 Screening compound: 1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-propylurea

V008-6505 Screening compound: 1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-propylurea
V008-6505 Screening compound: 1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-6505
1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-propylurea

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

V008-6505

Molecular Formula

C28H43N7O3 (C28 H43 N7 O3)

Compound Name

1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-propylurea

IUPAC name

1-[2-(diethylamino)ethyl]-1-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-3-propylurea

SMILES

CCCNC(N(CCN(CC)CC)CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C28H43N7O3/c1-5-15-29-28(37)35(19-18-32(6-2)7-3)22-27(36)34-17-8-16-33(20-21-34)26-14-13-25(30-31-26)23-9-11-24(38-4)12-10-23/h9-14H,5-8,15-22H2,1-4H3,(H,29,37)

InChI Key

GXSXVFSQHPWACH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19839924

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

525.69

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.361

Distribution Coefficient, logD

0.135

Water Solubility, LogSw

-3.28

Polar Surface Area

78.557

Acid Dissociation Constant (pKa)

17.04

Base Dissociation Constant (pKb)

10.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

V008-6505 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V008-6505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-6505?
Check Price and Availability of V008-6505, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V008-6505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-6505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-6505
  • 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 V008-6505 available by request