0601-0873 Screening compound: 2-{5-[1-(2-methoxyacetamido)cyclopentyl]-1H-1,2,3,4-tetrazol-1-yl}ethyl N-(4-chlorophenyl)carbamate

0601-0873 Screening compound: 2-{5-[1-(2-methoxyacetamido)cyclopentyl]-1H-1,2,3,4-tetrazol-1-yl}ethyl N-(4-chlorophenyl)carbamate
0601-0873 Screening compound: 2-{5-[1-(2-methoxyacetamido)cyclopentyl]-1H-1,2,3,4-tetrazol-1-yl}ethyl N-(4-chlorophenyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0601-0873
2-{5-[1-(2-methoxyacetamido)cyclopentyl]-1H-1,2,3,4-tetrazol-1-yl}ethyl N-(4-chlorophenyl)carbamate

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

0601-0873

Molecular Formula

C18H23ClN6O4 (C18 H23 ClN6 O4)

Compound Name

2-{5-[1-(2-methoxyacetamido)cyclopentyl]-1H-1,2,3,4-tetrazol-1-yl}ethyl N-(4-chlorophenyl)carbamate

IUPAC name

n/a

SMILES

COCC(NC1(CCCC1)c1nnnn1CCOC(Nc(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C18H23ClN6O4/c1-28-12-15(26)21-18(8-2-3-9-18)16-22-23-24-25(16)10-11-29-17(27)20-14-6-4-13(19)5-7-14/h4-7H,2-3,8-12H2,1H3,(H,20,27)(H,21,26)

InChI Key

OBAXILFVZPBZCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00339660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.87

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.156

Distribution Coefficient, logD

2.155

Water Solubility, LogSw

-3.00

Polar Surface Area

103.912

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

0601-0873 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0601-0873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0601-0873?
Check Price and Availability of 0601-0873, 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 0601-0873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0601-0873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0601-0873
  • 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 0601-0873 available by request