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Structure

2-Amino-4-(2,5-dimethylphenyl)-5-thiazolecarboxylic acid ethyl ester

CAS
899352-49-9
Catalog Number
ACM899352499
Category
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What is the molecular formula of the compound with PubChem CID 90477362?

The molecular formula is C14H16N2O2S.

What are the synonyms of the compound with PubChem CID 90477362?

The synonyms are SCHEMBL17844007 and 899352-49-9.

What is the molecular weight of the compound with PubChem CID 90477362?

The molecular weight is 276.36 g/mol.

What is the IUPAC name of the compound with PubChem CID 90477362?

The IUPAC name is ethyl 2-amino-4-(2,5-dimethylphenyl)-1,3-thiazole-5-carboxylate.

What is the InChI of the compound with PubChem CID 90477362?

The InChI is InChI=1S/C14H16N2O2S/c1-4-18-13(17)12-11(16-14(15)19-12)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3,(H2,15,16).

What is the InChIKey of the compound with PubChem CID 90477362?

The InChIKey is WMEMRNCQWBGHIB-UHFFFAOYSA-N.

What is the canonical SMILES of the compound with PubChem CID 90477362?

The canonical SMILES is CCOC(=O)C1=C(N=C(S1)N)C2=C(C=CC(=C2)C).

What is the XLogP3-AA value of the compound with PubChem CID 90477362?

The XLogP3-AA value is 3.5.

How many hydrogen bond donor counts does the compound with PubChem CID 90477362 have?

The compound has 1 hydrogen bond donor count.

How many rotatable bond counts does the compound with PubChem CID 90477362 have?

The compound has 4 rotatable bond counts.

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