2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide

C22H21BrN2O4S — CID 25362129

IUPAC2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br
InChIInChI=1S/C22H21BrN2O4S/c23-21-10-9-19(30(27,28)24-14-18-6-3-11-29-18)13-20(21)22(26)25-17-8-7-15-4-1-2-5-16(15)12-17/h1-2,4-5,7-10,12-13,18,24H,3,6,11,14H2,(H,25,26)/t18-/m1/s1
InChIKeyUYZUKTZOOPPTPN-GOSISDBHSA-N
MW489.39 g/mol
LogP4.31
Rot. Bonds6

About 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide

2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide (PubChem CID 25362129) has the molecular formula C22H21BrN2O4S and a molecular weight of 489.39 g/mol. Its IUPAC name is 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide.

Molecular Properties

Compound Name2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
PubChem CID25362129
Molecular FormulaC22H21BrN2O4S
Molecular Weight489.39 g/mol
Exact Mass488.04
IUPAC Name2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br
InChIInChI=1S/C22H21BrN2O4S/c23-21-10-9-19(30(27,28)24-14-18-6-3-11-29-18)13-20(21)22(26)25-17-8-7-15-4-1-2-5-16(15)12-17/h1-2,4-5,7-10,12-13,18,24H,3,6,11,14H2,(H,25,26)/t18-/m1/s1
InChIKeyUYZUKTZOOPPTPN-GOSISDBHSA-N
XLogP4.31
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.39
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-oxo-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]chromene-3-carboxamide
CID 1137148
N-(4-bromo-3-methylphenyl)-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 24646358
2-naphthalen-2-yloxy-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]acetamide
CID 17105928
2-fluoro-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 1094176
3-[[(2-bromobenzoyl)amino]carbamoyl]-N-(oxolan-2-ylmethyl)benzenesulfonamide
CID 46652327
N-(4-acetamidophenyl)-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 24539464
3-fluoro-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 1094225
N,2-dimethyl-5-[[(2S)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 7477477
N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2-propoxybenzamide
CID 17161199
N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide
CID 17147844
2,6-dichloro-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 3158279
2-methyl-5-(oxolan-2-ylmethylsulfamoyl)benzoic acid
CID 43081600

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The IUPAC name of 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide (CID 25362129) is 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide.
What is the SMILES notation for 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The canonical SMILES for 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide is O=C(Nc1ccc2ccccc2c1)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br.
What is the InChIKey of 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The InChIKey is UYZUKTZOOPPTPN-GOSISDBHSA-N. The full InChI is InChI=1S/C22H21BrN2O4S/c23-21-10-9-19(30(27,28)24-14-18-6-3-11-29-18)13-20(21)22(26)25-17-8-7-15-4-1-2-5-16(15)12-17/h1-2,4-5,7-10,12-13,18,24H,3,6,11,14H2,(H,25,26)/t18-/m1/s1.
What are the key properties of 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide has a molecular weight of 489.39 g/mol, XLogP of 4.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide is sourced from PubChem (CID 25362129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).