H027-0251C Screening compound: 2,4-bis[(dimethylamino)methyl]-5-hydroxy-N,N,1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide

H027-0251C Screening compound: 2,4-bis[(dimethylamino)methyl]-5-hydroxy-N,N,1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide
H027-0251C Screening compound: 2,4-bis[(dimethylamino)methyl]-5-hydroxy-N,N,1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound H027-0251C
2,4-bis[(dimethylamino)methyl]-5-hydroxy-N,N,1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide

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

H027-0251C

Molecular Formula

C23H31N5O2 (C23 H31 N5 O2)

Compound Name

2,4-bis[(dimethylamino)methyl]-5-hydroxy-N,N,1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide

IUPAC name

24-bis[(dimethylamino)methyl]-5-hydroxy-NN1-trimethyl-6-(pyridin-3-yl)-1H-indole-3-carboxamide

SMILES

CN(C)Cc(n(C)c1c2)c(C(N(C)C)=O)c1c(CN(C)C)c(O)c2-c1cnccc1

InChI

InChI=1S/C23H31N5O2/c1-25(2)13-17-20-18(11-16(22(17)29)15-9-8-10-24-12-15)28(7)19(14-26(3)4)21(20)23(30)27(5)6/h8-12,29H,13-14H2,1-7H3

InChI Key

XASPAGNFRZBSJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214782

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.537

Distribution Coefficient, logD

-3.577

Water Solubility, LogSw

-1.70

Polar Surface Area

50.532

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

11.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

H027-0251C in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with H027-0251C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H027-0251C?
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What is the minimum amount of H027-0251C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H027-0251C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H027-0251C
  • 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 H027-0251C available by request