L995-0205 Screening compound: methyl 4-[3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamido]benzoate

L995-0205 Screening compound: methyl 4-[3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamido]benzoate
L995-0205 Screening compound: methyl 4-[3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound L995-0205
methyl 4-[3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamido]benzoate

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

L995-0205

Molecular Formula

C20H19N3O6S (C20 H19 N3 O6 S)

Compound Name

methyl 4-[3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamido]benzoate

IUPAC name

methyl 4-[3-(pyrrolidine-1-carbonyl)-12-benzoxazole-5-sulfonamido]benzoate

SMILES

COC(c(cc1)ccc1NS(c(cc1)cc2c1onc2C(N1CCCC1)=O)(=O)=O)=O

InChI

InChI=1S/C20H19N3O6S/c1-28-20(25)13-4-6-14(7-5-13)22-30(26,27)15-8-9-17-16(12-15)18(21-29-17)19(24)23-10-2-3-11-23/h4-9,12,22H,2-3,10-11H2,1H3

InChI Key

GHANCQFFYJURLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27491337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.45

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.958

Distribution Coefficient, logD

2.521

Water Solubility, LogSw

-3.58

Polar Surface Area

101.275

Acid Dissociation Constant (pKa)

7.16

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with L995-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L995-0205?
Check Price and Availability of L995-0205, 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 L995-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L995-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L995-0205
  • 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 L995-0205 available by request