N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide

C17H16N2O5S — CID 78318344

IUPACN-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1)c1ccccc1
InChIInChI=1S/C17H16N2O5S/c20-16(12-4-2-1-3-5-12)18-13-6-8-14(9-7-13)25(22,23)19-15-10-11-24-17(15)21/h1-9,15,19H,10-11H2,(H,18,20)/t15-/m0/s1
InChIKeyBAEDWJHMTWEEAG-HNNXBMFYSA-N
MW360.39 g/mol
LogP1.53
Rot. Bonds5

About N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide

N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide (PubChem CID 78318344) has the molecular formula C17H16N2O5S and a molecular weight of 360.39 g/mol. Its IUPAC name is N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide
PubChem CID78318344
Molecular FormulaC17H16N2O5S
Molecular Weight360.39 g/mol
Exact Mass360.08
IUPAC NameN-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1)c1ccccc1
InChIInChI=1S/C17H16N2O5S/c20-16(12-4-2-1-3-5-12)18-13-6-8-14(9-7-13)25(22,23)19-15-10-11-24-17(15)21/h1-9,15,19H,10-11H2,(H,18,20)/t15-/m0/s1
InChIKeyBAEDWJHMTWEEAG-HNNXBMFYSA-N
XLogP1.53
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide?
The IUPAC name of N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide (CID 78318344) is N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide.
What is the SMILES notation for N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide?
The canonical SMILES for N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1)c1ccccc1.
What is the InChIKey of N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide?
The InChIKey is BAEDWJHMTWEEAG-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H16N2O5S/c20-16(12-4-2-1-3-5-12)18-13-6-8-14(9-7-13)25(22,23)19-15-10-11-24-17(15)21/h1-9,15,19H,10-11H2,(H,18,20)/t15-/m0/s1.
What are the key properties of N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide?
N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide has a molecular weight of 360.39 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 78318344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).