8018-7470 Screening compound: 2,6-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3,4-dihydropyrimidin-4-one

8018-7470 Screening compound: 2,6-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3,4-dihydropyrimidin-4-one
8018-7470 Screening compound: 2,6-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7470
2,6-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3,4-dihydropyrimidin-4-one

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

8018-7470

Molecular Formula

C14H11ClN8O2S (C14 H11 ClN8 O2 S)

Compound Name

2,6-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl]-3,4-dihydropyrimidin-4-one

IUPAC name

26-diamino-5-[2-amino-6-(5-chlorothiophen-2-yl)-4-oxo-3H4H7H-pyrrolo[23-d]pyrimidin-5-yl]-34-dihydropyrimidin-4-one

SMILES

NC(N=C(N)N1)=C(c2c(-c(s3)ccc3Cl)[nH]c(N=C(N)N3)c2C3=O)C1=O

InChI

InChI=1S/C14H11ClN8O2S/c15-4-2-1-3(26-4)8-5(6-9(16)20-13(17)22-11(6)24)7-10(19-8)21-14(18)23-12(7)25/h1-2H,(H5,16,17,20,22,24)(H4,18,19,21,23,25)

InChI Key

GBMXCWFYVVOJAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08142902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

9.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.074

Distribution Coefficient, logD

0.004

Water Solubility, LogSw

-2.93

Polar Surface Area

145.549

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8018-7470 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-7470 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7470?
Check Price and Availability of 8018-7470, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8018-7470 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7470
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7470
  • 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 8018-7470 available by request