D627-0270 Screening compound: 5-(3,4-dimethylphenyl)-1-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide

D627-0270 Screening compound: 5-(3,4-dimethylphenyl)-1-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide
D627-0270 Screening compound: 5-(3,4-dimethylphenyl)-1-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D627-0270
5-(3,4-dimethylphenyl)-1-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-pyridylmethyl)-1H-pyrazole-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

D627-0270

Molecular Formula

C22H24N4O3S (C22 H24 N4 O3 S)

Compound Name

5-(3,4-dimethylphenyl)-1-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide

IUPAC name

5-(34-dimethylphenyl)-1-(11-dioxo-1lambda6-thiolan-3-yl)-N-[(pyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide

SMILES

Cc(cc1)c(C)cc1-c1cc(C(NCc2cnccc2)=O)nn1C(CC1)CS1(=O)=O

InChI

InChI=1S/C22H24N4O3S/c1-15-5-6-18(10-16(15)2)21-11-20(22(27)24-13-17-4-3-8-23-12-17)25-26(21)19-7-9-30(28,29)14-19/h3-6,8,10-12,19H,7,9,13-14H2,1-2H3,(H,24,27)/t19-/m1/s1

InChI Key

TXLNAUIJMRORQF-LJQANCHMSA-N

MDL Number (MFCD)

MFCD15142258

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.142

Distribution Coefficient, logD

2.142

Water Solubility, LogSw

-2.30

Polar Surface Area

75.263

Acid Dissociation Constant (pKa)

13.88

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with D627-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D627-0270?
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What is the minimum amount of D627-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D627-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D627-0270
  • 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 D627-0270 available by request