Structure

3,5-dichloro-6-ethylpyrazine-2-carboxamide

CAS
313340-08-8
Catalog Number
ACM313340088
Category
Pyrazines
Molecular Weight
220.0
Molecular Formula
C7H7Cl2N3O

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What is the molecular formula of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The molecular formula is C7H7Cl2N3O.

What is the molecular weight of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The molecular weight is 220.05 g/mol.

What is the IUPAC name of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The IUPAC name is 3,5-dichloro-6-ethylpyrazine-2-carboxamide.

What is the InChI string of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The InChI string is InChI=1S/C7H7Cl2N3O/c1-2-3-5(8)12-6(9)4(11-3)7(10)13/h2H2,1H3,(H2,10,13).

What is the InChIKey of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The InChIKey is KMIXLCQPYRNBEH-UHFFFAOYSA-N.

What is the Canonical SMILES of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The Canonical SMILES is CCC1=C(N=C(C(=N1)C(=O)N)Cl)Cl.

What is the XLogP3-AA value of 3,5-dichloro-6-ethylpyrazine-2-carboxamide?

The XLogP3-AA value is 1.7.

How many hydrogen bond donor counts does 3,5-dichloro-6-ethylpyrazine-2-carboxamide have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 3,5-dichloro-6-ethylpyrazine-2-carboxamide have?

It has 3 hydrogen bond acceptor counts.

How many rotatable bond counts does 3,5-dichloro-6-ethylpyrazine-2-carboxamide have?

It has 2 rotatable bond counts.

Downstream Synthesis Route 1

  • 313340-08-8
  • 1254055-46-3

Reference: [1] Patent: US2012/40968, 2012, A1, . Location in patent: Page/Page column 22

Downstream Synthesis Route 2

  • 313340-08-8
  • 1254055-46-3

Reference: [1]Patent: US2012/40968,2012,A1 .Location in patent: Page/Page column 22

Downstream Synthesis Route 3

  • 313340-08-8
  • 1254048-03-7

Reference: [1]Patent: US2012/40968,2012,A1

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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