V025-7621 Screening compound: methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

V025-7621 Screening compound: methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
V025-7621 Screening compound: methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-7621
methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

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

V025-7621

Molecular Formula

C21H24N2O5 (C21 H24 N2 O5)

Compound Name

methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

methyl 4-{2-[1-(3-methoxyphenyl)-N-(prop-2-en-1-yl)formamido]acetyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

Cc1c(C(OC)=O)[nH]c(C)c1C(CN(CC=C)C(c1cc(OC)ccc1)=O)=O

InChI

InChI=1S/C21H24N2O5/c1-6-10-23(20(25)15-8-7-9-16(11-15)27-4)12-17(24)18-13(2)19(21(26)28-5)22-14(18)3/h6-9,11,22H,1,10,12H2,2-5H3

InChI Key

UYYIRALTNZMKFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14254232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.493

Distribution Coefficient, logD

2.493

Water Solubility, LogSw

-2.80

Polar Surface Area

69.374

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

-4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V025-7621 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-7621?
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What is the minimum amount of V025-7621 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-7621
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-7621
  • 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 V025-7621 available by request