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Structure

(S)-Isoquinoline-5-sulfonic acid(pyrrolidin-2-ylmethyl)-amide

CAS
936233-16-8
Catalog Number
ACM936233168
Category
Other Products
Molecular Weight
291.373
Molecular Formula
C14H17N3O2S

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Specification

Synonyms
(S)-Isoquinoline-5-sulfonic acid (pyrrolidin-2-ylmethyl)-amide
What is the molecular formula of the compound with PubChem CID 23647021?

The molecular formula is C14H17N3O2S.

When was the compound first created in PubChem?

The compound was first created on January 19, 2008.

What is the molecular weight of the compound?

The molecular weight is 291.37 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is N-[[(2S)-pyrrolidin-2-yl]methyl]isoquinoline-5-sulfonamide.

What is the InChIKey of the compound?

The InChIKey is CMAVUZPUJHRVSP-LBPRGKRZSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.2.

What is the topological polar surface area of the compound?

The topological polar surface area is 79.5 Ų.

How many defined atom stereocenter counts does the compound have?

The compound has 1 defined atom stereocenter count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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