2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide

C19H20Cl2N2O4S — CID 112803399

IUPAC2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H20Cl2N2O4S/c20-16-6-3-7-17(21)18(16)19(24)22-12-14-4-1-2-5-15(14)13-28(25,26)23-8-10-27-11-9-23/h1-7H,8-13H2,(H,22,24)
InChIKeyADMGEBCGGOFKTC-UHFFFAOYSA-N
MW443.35 g/mol
LogP3.09
Rot. Bonds6

About 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide

2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide (PubChem CID 112803399) has the molecular formula C19H20Cl2N2O4S and a molecular weight of 443.35 g/mol. Its IUPAC name is 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
PubChem CID112803399
Molecular FormulaC19H20Cl2N2O4S
Molecular Weight443.35 g/mol
Exact Mass442.05
IUPAC Name2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H20Cl2N2O4S/c20-16-6-3-7-17(21)18(16)19(24)22-12-14-4-1-2-5-15(14)13-28(25,26)23-8-10-27-11-9-23/h1-7H,8-13H2,(H,22,24)
InChIKeyADMGEBCGGOFKTC-UHFFFAOYSA-N
XLogP3.09
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.35
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]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

5-chloro-3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-1-phenylpyrazole-4-carboxamide
CID 16574483
5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 18120484
3,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-1,2-oxazole-4-carboxamide
CID 25404526
2-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 24541772
3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 17409313
2-(methylamino)-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]acetamide;hydrochloride
CID 119697573
N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-4-pyrrol-1-ylbenzamide
CID 24541820
3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]furan-2-carboxamide
CID 17408204
(2R)-2-amino-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]propanamide
CID 119275554
5-chloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 27702531
2,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 24535412
1-amino-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119697559

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide (CID 112803399) is 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide is O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The InChIKey is ADMGEBCGGOFKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O4S/c20-16-6-3-7-17(21)18(16)19(24)22-12-14-4-1-2-5-15(14)13-28(25,26)23-8-10-27-11-9-23/h1-7H,8-13H2,(H,22,24).
What are the key properties of 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide has a molecular weight of 443.35 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 112803399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).