1501-0175 Screening compound: 3-(2,2-dichloroethenyl)-2,2-dimethyl-N-{2,2,2-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide

1501-0175 Screening compound: 3-(2,2-dichloroethenyl)-2,2-dimethyl-N-{2,2,2-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide
1501-0175 Screening compound: 3-(2,2-dichloroethenyl)-2,2-dimethyl-N-{2,2,2-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1501-0175
3-(2,2-dichloroethenyl)-2,2-dimethyl-N-{2,2,2-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide

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

1501-0175

Molecular Formula

C17H19Cl5N2O2 (C17 H19 Cl5 N2 O2)

Compound Name

3-(2,2-dichloroethenyl)-2,2-dimethyl-N-{2,2,2-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide

IUPAC name

3-(22-dichloroethenyl)-22-dimethyl-N-{222-trichloro-1-[(2-methoxyphenyl)amino]ethyl}cyclopropane-1-carboxamide

SMILES

CC(C)(C1C=C(Cl)Cl)C1C(NC(C(Cl)(Cl)Cl)Nc(cccc1)c1OC)=O

InChI

InChI=1S/C17H19Cl5N2O2/c1-16(2)9(8-12(18)19)13(16)14(25)24-15(17(20,21)22)23-10-6-4-5-7-11(10)26-3/h4-9,13,15,23H,1-3H3,(H,24,25)

InChI Key

CAVYSPUIATUHGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00790413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.61

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.245

Distribution Coefficient, logD

5.219

Water Solubility, LogSw

-5.67

Polar Surface Area

40.905

Acid Dissociation Constant (pKa)

8.62

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

47.10

1501-0175 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1501-0175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1501-0175?
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What is the minimum amount of 1501-0175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1501-0175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1501-0175
  • 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 1501-0175 available by request