V005-1956 Screening compound: ethyl 4-{2-[1-(3-methoxyphenyl)-N-[(pyridin-2-yl)methyl]formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

V005-1956 Screening compound: ethyl 4-{2-[1-(3-methoxyphenyl)-N-[(pyridin-2-yl)methyl]formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
V005-1956 Screening compound: ethyl 4-{2-[1-(3-methoxyphenyl)-N-[(pyridin-2-yl)methyl]formamido]acetyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-1956
ethyl 4-{2-[1-(3-methoxyphenyl)-N-[(pyridin-2-yl)methyl]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

V005-1956

Molecular Formula

C25H27N3O5 (C25 H27 N3 O5)

Compound Name

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

IUPAC name

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

SMILES

CCOC(c1c(C)c(C(CN(Cc2ncccc2)C(c2cc(OC)ccc2)=O)=O)c(C)[nH]1)=O

InChI

InChI=1S/C25H27N3O5/c1-5-33-25(31)23-16(2)22(17(3)27-23)21(29)15-28(14-19-10-6-7-12-26-19)24(30)18-9-8-11-20(13-18)32-4/h6-13,27H,5,14-15H2,1-4H3

InChI Key

YJTGHXREOBVZKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14254383

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

449.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.657

Distribution Coefficient, logD

2.657

Water Solubility, LogSw

-2.92

Polar Surface Area

78.247

Acid Dissociation Constant (pKa)

6.10

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with V005-1956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-1956?
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What is the minimum amount of V005-1956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-1956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-1956
  • 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 V005-1956 available by request