D277-1444 Screening compound: N-({1-[(4-tert-butylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methyl)-N-methylacetamide

D277-1444 Screening compound: N-({1-[(4-tert-butylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methyl)-N-methylacetamide
D277-1444 Screening compound: N-({1-[(4-tert-butylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methyl)-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-1444
N-({1-[(4-tert-butylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methyl)-N-methylacetamide

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

D277-1444

Molecular Formula

C22H27N3O (C22 H27 N3 O)

Compound Name

N-({1-[(4-tert-butylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methyl)-N-methylacetamide

IUPAC name

N-({1-[(4-tert-butylphenyl)methyl]-1H-13-benzodiazol-2-yl}methyl)-N-methylacetamide

SMILES

CC(C)(C)c1ccc(Cn2c(cccc3)c3nc2CN(C)C(C)=O)cc1

InChI

InChI=1S/C22H27N3O/c1-16(26)24(5)15-21-23-19-8-6-7-9-20(19)25(21)14-17-10-12-18(13-11-17)22(2,3)4/h6-13H,14-15H2,1-5H3

InChI Key

JILBXEQMSFKOHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08362156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.609

Distribution Coefficient, logD

4.609

Water Solubility, LogSw

-4.42

Polar Surface Area

28.033

Acid Dissociation Constant (pKa)

22.60

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with D277-1444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-1444?
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What is the minimum amount of D277-1444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-1444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-1444
  • 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 D277-1444 available by request