V030-5826 Screening compound: 1-{2-[3-(3,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

V030-5826 Screening compound: 1-{2-[3-(3,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea
V030-5826 Screening compound: 1-{2-[3-(3,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5826
1-{2-[3-(3,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-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

V030-5826

Molecular Formula

C30H41N5O3 (C30 H41 N5 O3)

Compound Name

1-{2-[3-(3,4-dimethylphenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

IUPAC name

1-{2-[3-(34-dimethylphenyl)-5-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1-[2-(morpholin-4-yl)ethyl]-3-propylurea

SMILES

CCCNC(N(CCN1CCOCC1)CC(N(C(C1)c2ccc(C)cc2)N=C1c1cc(C)c(C)cc1)=O)=O

InChI

InChI=1S/C30H41N5O3/c1-5-12-31-30(37)34(14-13-33-15-17-38-18-16-33)21-29(36)35-28(25-9-6-22(2)7-10-25)20-27(32-35)26-11-8-23(3)24(4)19-26/h6-11,19,28H,5,12-18,20-21H2,1-4H3,(H,31,37)/t28-/m0/s1

InChI Key

XWQKHMGTOFWLCP-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19797760

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

519.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.878

Distribution Coefficient, logD

4.127

Water Solubility, LogSw

-4.48

Polar Surface Area

64.924

Acid Dissociation Constant (pKa)

17.04

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V030-5826 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V030-5826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5826?
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What is the minimum amount of V030-5826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5826
  • 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 V030-5826 available by request