2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide

C22H24N4O3S — CID 17434238

IUPAC2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCOc1ccc(-n2ccnc2SCC(=O)Nc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C22H24N4O3S/c1-28-18-8-6-17(7-9-18)26-11-10-23-22(26)30-16-21(27)24-19-4-2-3-5-20(19)25-12-14-29-15-13-25/h2-11H,12-16H2,1H3,(H,24,27)
InChIKeyADZDQYCEYDCHNX-UHFFFAOYSA-N
MW424.53 g/mol
LogP3.45
Rot. Bonds7

About 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide

2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 17434238) has the molecular formula C22H24N4O3S and a molecular weight of 424.53 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID17434238
Molecular FormulaC22H24N4O3S
Molecular Weight424.53 g/mol
Exact Mass424.16
IUPAC Name2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCOc1ccc(-n2ccnc2SCC(=O)Nc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C22H24N4O3S/c1-28-18-8-6-17(7-9-18)26-11-10-23-22(26)30-16-21(27)24-19-4-2-3-5-20(19)25-12-14-29-15-13-25/h2-11H,12-16H2,1H3,(H,24,27)
InChIKeyADZDQYCEYDCHNX-UHFFFAOYSA-N
XLogP3.45
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.53
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methoxyphenyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetamide
CID 3636346
2-[[2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-phenylbenzamide
CID 41434287
2-[1-(4-ethoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-methoxyphenyl)acetamide
CID 3674449
2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(4-methylphenyl)acetamide
CID 4120310
2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone
CID 40684880
N-(4-bromophenyl)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanylacetamide
CID 4119542
2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-methylphenyl)acetamide
CID 30802274
2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 4680043
N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetamide
CID 3957299
N-(4-methoxyphenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109009136
(2R)-2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide
CID 41156326
5-(4-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)pentanamide
CID 110297867

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide (CID 17434238) is 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide is COc1ccc(-n2ccnc2SCC(=O)Nc2ccccc2N2CCOCC2)cc1.
What is the InChIKey of 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is ADZDQYCEYDCHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3S/c1-28-18-8-6-17(7-9-18)26-11-10-23-22(26)30-16-21(27)24-19-4-2-3-5-20(19)25-12-14-29-15-13-25/h2-11H,12-16H2,1H3,(H,24,27).
What are the key properties of 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 424.53 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 17434238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).