G500-0814 Screening compound: 1-CYCLOHEXYL-3-[2-(2,3-DIHYDRO-1H-INDOL-1-YL)-2-[4-(DIMETHYLAMINO)PHENYL]ETHYL]UREA

G500-0814 Screening compound: 1-CYCLOHEXYL-3-[2-(2,3-DIHYDRO-1H-INDOL-1-YL)-2-[4-(DIMETHYLAMINO)PHENYL]ETHYL]UREA
G500-0814 Screening compound: 1-CYCLOHEXYL-3-[2-(2,3-DIHYDRO-1H-INDOL-1-YL)-2-[4-(DIMETHYLAMINO)PHENYL]ETHYL]UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound G500-0814
1-CYCLOHEXYL-3-[2-(2,3-DIHYDRO-1H-INDOL-1-YL)-2-[4-(DIMETHYLAMINO)PHENYL]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

G500-0814

Molecular Formula

C25H34N4O (C25 H34 N4 O)

Compound Name

1-CYCLOHEXYL-3-[2-(2,3-DIHYDRO-1H-INDOL-1-YL)-2-[4-(DIMETHYLAMINO)PHENYL]ETHYL]UREA

IUPAC name

n/a

SMILES

CN(C)c1ccc(C(CNC(NC2CCCCC2)=O)N(CC2)c3c2cccc3)cc1

InChI

InChI=1S/C25H34N4O/c1-28(2)22-14-12-20(13-15-22)24(29-17-16-19-8-6-7-11-23(19)29)18-26-25(30)27-21-9-4-3-5-10-21/h6-8,11-15,21,24H,3-5,9-10,16-18H2,1-2H3,(H2,26,27,30)/t24-/m0/s1

InChI Key

IRFIDQPXXBJVDG-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD08005550

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.57

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.899

Distribution Coefficient, logD

4.893

Water Solubility, LogSw

-4.37

Polar Surface Area

39.736

Acid Dissociation Constant (pKa)

15.72

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

G500-0814 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G500-0814 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G500-0814?
Check Price and Availability of G500-0814, 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 G500-0814 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G500-0814
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G500-0814
  • 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 G500-0814 available by request