N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide

C20H17NO4S — CID 21136439

IUPACN-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2c(c1)C(c1ccccc1)Oc1cccc(O)c1-2
InChIInChI=1S/C20H17NO4S/c1-26(23,24)21-14-10-11-15-16(12-14)20(13-6-3-2-4-7-13)25-18-9-5-8-17(22)19(15)18/h2-12,20-22H,1H3
InChIKeyJNNJFIIQFCFXID-UHFFFAOYSA-N
MW367.43 g/mol
LogP3.91
Rot. Bonds3

About N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide

N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide (PubChem CID 21136439) has the molecular formula C20H17NO4S and a molecular weight of 367.43 g/mol. Its IUPAC name is N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide
PubChem CID21136439
Molecular FormulaC20H17NO4S
Molecular Weight367.43 g/mol
Exact Mass367.09
IUPAC NameN-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2c(c1)C(c1ccccc1)Oc1cccc(O)c1-2
InChIInChI=1S/C20H17NO4S/c1-26(23,24)21-14-10-11-15-16(12-14)20(13-6-3-2-4-7-13)25-18-9-5-8-17(22)19(15)18/h2-12,20-22H,1H3
InChIKeyJNNJFIIQFCFXID-UHFFFAOYSA-N
XLogP3.91
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide?
The IUPAC name of N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide (CID 21136439) is N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide.
What is the SMILES notation for N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide?
The canonical SMILES for N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide is CS(=O)(=O)Nc1ccc2c(c1)C(c1ccccc1)Oc1cccc(O)c1-2.
What is the InChIKey of N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide?
The InChIKey is JNNJFIIQFCFXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO4S/c1-26(23,24)21-14-10-11-15-16(12-14)20(13-6-3-2-4-7-13)25-18-9-5-8-17(22)19(15)18/h2-12,20-22H,1H3.
What are the key properties of N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide?
N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide has a molecular weight of 367.43 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-6-phenyl-6H-benzo[c]chromen-8-yl)methanesulfonamide is sourced from PubChem (CID 21136439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).