2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide

C26H20N2OS — CID 3849054

IUPAC2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide
SMILESO=C(Nc1ccccc1)C(Sc1ccccc1)n1c2ccccc2c2ccccc21
InChIInChI=1S/C26H20N2OS/c29-25(27-19-11-3-1-4-12-19)26(30-20-13-5-2-6-14-20)28-23-17-9-7-15-21(23)22-16-8-10-18-24(22)28/h1-18,26H,(H,27,29)
InChIKeyGUIUEBPSQQEEFW-UHFFFAOYSA-N
MW408.53 g/mol
LogP6.72
Rot. Bonds5

About 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide

2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide (PubChem CID 3849054) has the molecular formula C26H20N2OS and a molecular weight of 408.53 g/mol. Its IUPAC name is 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound Name2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide
PubChem CID3849054
Molecular FormulaC26H20N2OS
Molecular Weight408.53 g/mol
Exact Mass408.13
IUPAC Name2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide
SMILESO=C(Nc1ccccc1)C(Sc1ccccc1)n1c2ccccc2c2ccccc21
InChIInChI=1S/C26H20N2OS/c29-25(27-19-11-3-1-4-12-19)26(30-20-13-5-2-6-14-20)28-23-17-9-7-15-21(23)22-16-8-10-18-24(22)28/h1-18,26H,(H,27,29)
InChIKeyGUIUEBPSQQEEFW-UHFFFAOYSA-N
XLogP6.72
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.53
LogP ≤ 56.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-2-phenylsulfanylpropanamide
CID 2889315
(2S)-N,2-diphenyl-2-phenylsulfanylacetamide
CID 821034
N,2-diphenyl-2-phenylsulfanylacetamide
CID 2885898
N-phenyl-2-[4-(phenylcarbamoylamino)phenyl]sulfanylpropanamide
CID 19712373
N-(4-aminophenyl)-2-phenylsulfanylpropanamide
CID 43187412
(2R)-N-(4-acetylphenyl)-2-phenylsulfanylpropanamide
CID 2501504
(2S)-N-(4-methoxyphenyl)-2-phenylsulfanylpropanamide
CID 875705
(2R)-N-(4-phenoxyphenyl)-2-phenylsulfanylpropanamide
CID 875522
N-(4-ethylphenyl)-2-phenylsulfanylpropanamide
CID 2928214
2-(4-methyl-2-oxoquinolin-1-yl)-N-phenylbutanamide
CID 46301025
2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide
CID 19712403
N-(9-ethylcarbazol-3-yl)-2-[4-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide
CID 21167732

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide?
The IUPAC name of 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide (CID 3849054) is 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide?
The canonical SMILES for 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide is O=C(Nc1ccccc1)C(Sc1ccccc1)n1c2ccccc2c2ccccc21.
What is the InChIKey of 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide?
The InChIKey is GUIUEBPSQQEEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2OS/c29-25(27-19-11-3-1-4-12-19)26(30-20-13-5-2-6-14-20)28-23-17-9-7-15-21(23)22-16-8-10-18-24(22)28/h1-18,26H,(H,27,29).
What are the key properties of 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide?
2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide has a molecular weight of 408.53 g/mol, XLogP of 6.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-N-phenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 3849054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).