V018-8329 Screening compound: N~1~-butyl-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide

V018-8329 Screening compound: N~1~-butyl-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide
V018-8329 Screening compound: N~1~-butyl-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8329
N~1~-butyl-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide

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

V018-8329

Molecular Formula

C23H27N3O2 (C23 H27 N3 O2)

Compound Name

N~1~-butyl-2-[5-(2-methylphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinecarboxamide

IUPAC name

N-butyl-2-[5-(2-methylphenyl)-13-benzoxazol-2-yl]pyrrolidine-1-carboxamide

SMILES

CCCCNC(N(CCC1)C1c1nc(cc(cc2)-c3c(C)cccc3)c2o1)=O

InChI

InChI=1S/C23H27N3O2/c1-3-4-13-24-23(27)26-14-7-10-20(26)22-25-19-15-17(11-12-21(19)28-22)18-9-6-5-8-16(18)2/h5-6,8-9,11-12,15,20H,3-4,7,10,13-14H2,1-2H3,(H,24,27)/t20-/m0/s1

InChI Key

HMQUOYHPXQBLNS-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19969733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.530

Distribution Coefficient, logD

5.530

Water Solubility, LogSw

-5.29

Polar Surface Area

43.741

Acid Dissociation Constant (pKa)

16.74

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.13

References: we are preparing a list of scientific research reports with V018-8329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8329?
Check Price and Availability of V018-8329, 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 V018-8329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8329
  • 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 V018-8329 available by request