N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide

C19H16N2O2S2 — CID 7600839

IUPACN'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1cccs1
InChIInChI=1S/C19H16N2O2S2/c22-18(16-12-7-13-24-16)20-21-19(23)17(14-8-3-1-4-9-14)25-15-10-5-2-6-11-15/h1-13,17H,(H,20,22)(H,21,23)/t17-/m0/s1
InChIKeyOSWLRLUOVUPYBA-KRWDZBQOSA-N
MW368.48 g/mol
LogP4.04
Rot. Bonds5

About N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide

N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide (PubChem CID 7600839) has the molecular formula C19H16N2O2S2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide
PubChem CID7600839
Molecular FormulaC19H16N2O2S2
Molecular Weight368.48 g/mol
Exact Mass368.07
IUPAC NameN'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1cccs1
InChIInChI=1S/C19H16N2O2S2/c22-18(16-12-7-13-24-16)20-21-19(23)17(14-8-3-1-4-9-14)25-15-10-5-2-6-11-15/h1-13,17H,(H,20,22)(H,21,23)/t17-/m0/s1
InChIKeyOSWLRLUOVUPYBA-KRWDZBQOSA-N
XLogP4.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[3-[2-(4-iodoanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 18906376
N-[4-[2-oxo-1-phenyl-2-(pyridin-2-ylamino)ethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 22781894
N'-(3,3-diphenylpropanoyl)thiophene-2-carbohydrazide
CID 9479339
N'-(3-phenylsulfanylpropanoyl)thiophene-2-carbohydrazide
CID 9479389
N'-(2-phenyl-2-phenylsulfanylacetyl)-1H-pyrrole-2-carbohydrazide
CID 78813996
N-[3-[2-(4-carbamoylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 18906394
N-[4-[2-(3-chloro-4-fluoroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 23099768
N-[3-[2-oxo-1-phenyl-2-(4-propan-2-ylanilino)ethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 18906360
N-[3-[2-(2,3-dichloroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 18906343
N-[4-[2-(2,5-dichloroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 23101325
2-hydroxy-5-[[2-phenyl-2-[3-(thiophene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoic acid
CID 18906397
N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide
CID 22782420

Frequently Asked Questions

What is the IUPAC name of N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide?
The IUPAC name of N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide (CID 7600839) is N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide.
What is the SMILES notation for N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide?
The canonical SMILES for N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide is O=C(NNC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1cccs1.
What is the InChIKey of N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide?
The InChIKey is OSWLRLUOVUPYBA-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H16N2O2S2/c22-18(16-12-7-13-24-16)20-21-19(23)17(14-8-3-1-4-9-14)25-15-10-5-2-6-11-15/h1-13,17H,(H,20,22)(H,21,23)/t17-/m0/s1.
What are the key properties of N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide?
N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide has a molecular weight of 368.48 g/mol, XLogP of 4.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2S)-2-phenyl-2-phenylsulfanylacetyl]thiophene-2-carbohydrazide is sourced from PubChem (CID 7600839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).