D264-1013 Screening compound: 1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]urea

D264-1013 Screening compound: 1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]urea
D264-1013 Screening compound: 1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D264-1013
1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]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

D264-1013

Molecular Formula

C17H24ClN3O (C17 H24 ClN3 O)

Compound Name

1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]urea

IUPAC name

1-(2-chlorophenyl)-3-[(1-cyclopentylpyrrolidin-3-yl)methyl]urea

SMILES

O=C(NCC(CC1)CN1C1CCCC1)Nc(cccc1)c1Cl

InChI

InChI=1S/C17H24ClN3O/c18-15-7-3-4-8-16(15)20-17(22)19-11-13-9-10-21(12-13)14-5-1-2-6-14/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H2,19,20,22)/t13-/m1/s1

InChI Key

FCHUEDCGQOFVGL-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD14816099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.85

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.081

Distribution Coefficient, logD

-1.298

Water Solubility, LogSw

-3.39

Polar Surface Area

37.117

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

11.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.80

D264-1013 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D264-1013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D264-1013?
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What is the minimum amount of D264-1013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D264-1013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D264-1013
  • 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 D264-1013 available by request