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Structure

ACETAMIDE,2-[[4-(3-METHOXYPHENYL)-5-(PYRIDIN-3-YL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHYLPHENYL)-

CAS
943082-32-4
Catalog Number
ACM943082324
Category
Other Products
Molecular Weight
431.510140 [g/mol]
Molecular Formula
C23H21N5O2S

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Specification

Synonyms
943082-32-4, MolPort-002-031-069, ZINC35289141, AKOS000802570, KB-282577, 2-{[4-(3-Methoxyphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
IUPAC Name
2-[[4-(3-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)acetamide
InChI Key
REGDMRQNJTWIHQ-UHFFFAOYSA-N
Density
1.28±0.1 g/cm³ (20 °C, 760 mmHg)
Exact Mass
431.14200
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 43812928?

The molecular formula is C23H21N5O2S.

What are some synonyms of the compound with PubChem CID 43812928?

AKOS000802570, ACETAMIDE,2-[[4-(3-METHOXYPHENYL)-5-(PYRIDIN-3-YL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-N-(2-METHYLPHENYL)-.

What is the molecular weight of the compound with PubChem CID 43812928?

The molecular weight is 431.5 g/mol.

What is the IUPAC name of the compound with PubChem CID 43812928?

2-[[4-(3-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)acetamide.

What is the InChI key of the compound with PubChem CID 43812928?

REGDMRQNJTWIHQ-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound with PubChem CID 43812928 have?

1.

What is the XLogP3-AA value of the compound with PubChem CID 43812928?

3.8.

How many rotatable bond counts does the compound with PubChem CID 43812928 have?

7.

What is the topological polar surface area of the compound with PubChem CID 43812928?

107 Ų.

Is the compound with PubChem CID 43812928 canonicalized?

Yes.

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