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Structure

4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one

CAS
91996-78-0
Catalog Number
ACM91996780
Category
Other Products
Molecular Weight
179.2
Molecular Formula
C7H5N3OS

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Specification

Synonyms
4-THIOXO-3,4-DIHYDROPYRIDO[2,3-D]PYRIMIDIN-2(1H)-ONE
What is the molecular formula of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The molecular formula is C7H5N3OS.

When was 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one first created in PubChem?

It was first created in PubChem on October 23, 2008.

What is the IUPAC name of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The IUPAC name is 4-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-2-one.

What is the InChIKey of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The InChIKey is NLYPLDGOILHTHY-UHFFFAOYSA-N.

How many Hydrogen Bond Donor Count does 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one have?

It has 2 Hydrogen Bond Donor Count.

What is the topological polar surface area of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The topological polar surface area is 86.1 Å2.

Is 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one a canonicalized compound?

Yes, it is a canonicalized compound.

What is the XLogP3-AA value of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The XLogP3-AA value is 0.3.

How many defined atom stereocenter count does 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one have?

It has 0 defined atom stereocenter count.

What is the complexity value of 4-Thioxo-3,4-dihydropyrido[2,3-d]pyrimidin-2(1H)-one?

The complexity value is 231.

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