Structure

Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)

CAS
95502-62-8
Catalog Number
ACM95502628
Category
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What is the molecular formula of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The molecular formula is C9H8N2S.

What is the molecular weight of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The molecular weight is 176.24 g/mol.

What is the IUPAC name of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The IUPAC name is 5-thia-1,7-diazatricyclo[7.3.0.0 2,6 ]dodeca-2(6),3,9,11-tetraene.

What is the InChI of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The InChI is InChI=1S/C9H8N2S/c1-2-7-6-10-9-8(3-5-12-9)11(7)4-1/h1-5,10H,6H2.

What is the InChIKey of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The InChIKey is VTYOFYRMWXYDTJ-UHFFFAOYSA-N.

What is the canonical SMILES of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The canonical SMILES is C1C2=CC=CN2C3=C(N1)SC=C3.

What is the XLogP3-AA value of Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci)?

The XLogP3-AA value is 1.9.

How many hydrogen bond donor counts does Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci) have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci) have?

It has 2 hydrogen bond acceptor counts.

How many rotatable bond counts does Pyrrolo[1,2-a]thieno[3,2-e]pyrazine,4,5-dihydro-(9ci) have?

It has 0 rotatable bond counts.

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