V031-1837 Screening compound: N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxamide

V031-1837 Screening compound: N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxamide
V031-1837 Screening compound: N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1837
N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-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

V031-1837

Molecular Formula

C18H28N6O2 (C18 H28 N6 O2)

Compound Name

N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine-6-carboxamide

IUPAC name

N-ethyl-4-(morpholin-4-yl)-2-(pyrrolidin-1-yl)-5H6H7H8H-pyrido[43-d]pyrimidine-6-carboxamide

SMILES

CCNC(N1Cc2c(N3CCOCC3)nc(N3CCCC3)nc2CC1)=O

InChI

InChI=1S/C18H28N6O2/c1-2-19-18(25)24-8-5-15-14(13-24)16(22-9-11-26-12-10-22)21-17(20-15)23-6-3-4-7-23/h2-13H2,1H3,(H,19,25)

InChI Key

HTZVHOYTMRYHQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19908790

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

360.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.912

Distribution Coefficient, logD

1.896

Water Solubility, LogSw

-2.22

Polar Surface Area

60.700

Acid Dissociation Constant (pKa)

16.61

Base Dissociation Constant (pKb)

5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.20

V031-1837 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V031-1837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1837?
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What is the minimum amount of V031-1837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1837
  • 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 V031-1837 available by request