D662-0342 Screening compound: 2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

D662-0342 Screening compound: 2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine
D662-0342 Screening compound: 2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D662-0342
2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

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

D662-0342

Molecular Formula

C20H24ClN5O2 (C20 H24 ClN5 O2)

Compound Name

2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1,2,3,4-tetrazol-5-amine

IUPAC name

2-butyl-N-({4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}methyl)-2H-1234-tetrazol-5-amine

SMILES

CCCCn1nnc(NCc(cc2)cc(OC)c2OCc2cccc(Cl)c2)n1

InChI

InChI=1S/C20H24ClN5O2/c1-3-4-10-26-24-20(23-25-26)22-13-15-8-9-18(19(12-15)27-2)28-14-16-6-5-7-17(21)11-16/h5-9,11-12H,3-4,10,13-14H2,1-2H3,(H,22,24)

InChI Key

VRNOPTNRDWNVTM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13370307

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.345

Distribution Coefficient, logD

4.345

Water Solubility, LogSw

-4.49

Polar Surface Area

65.177

Acid Dissociation Constant (pKa)

16.57

Base Dissociation Constant (pKb)

1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with D662-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D662-0342?
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What is the minimum amount of D662-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D662-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D662-0342
  • 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 D662-0342 available by request