2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide

C20H22ClN3O6S — CID 25161543

IUPAC2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1
InChIInChI=1S/C20H22ClN3O6S/c1-2-30-15-5-3-14(4-6-15)19(25)22-23-20(26)17-13-16(7-8-18(17)21)31(27,28)24-9-11-29-12-10-24/h3-8,13H,2,9-12H2,1H3,(H,22,25)(H,23,26)
InChIKeySGEYWTAGVJNXNY-UHFFFAOYSA-N
MW467.93 g/mol
LogP1.83
Rot. Bonds6

About 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide

2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide (PubChem CID 25161543) has the molecular formula C20H22ClN3O6S and a molecular weight of 467.93 g/mol. Its IUPAC name is 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide.

Molecular Properties

Compound Name2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide
PubChem CID25161543
Molecular FormulaC20H22ClN3O6S
Molecular Weight467.93 g/mol
Exact Mass467.09
IUPAC Name2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1
InChIInChI=1S/C20H22ClN3O6S/c1-2-30-15-5-3-14(4-6-15)19(25)22-23-20(26)17-13-16(7-8-18(17)21)31(27,28)24-9-11-29-12-10-24/h3-8,13H,2,9-12H2,1H3,(H,22,25)(H,23,26)
InChIKeySGEYWTAGVJNXNY-UHFFFAOYSA-N
XLogP1.83
TPSA114.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.93
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide 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

4-fluoro-N'-(4-methoxybenzoyl)-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2528547
N'-(5-chloro-2-methoxybenzoyl)-4-fluoro-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2528605
4-((2,6-dimethylmorpholino)sulfonyl)-N'-(4-methoxybenzoyl)benzohydrazide
CID 4423007
2-chloro-N-[2-(4-methoxyphenyl)ethyl]-5-piperidin-1-ylsulfonylbenzamide
CID 16311346
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-4-methoxy-3-morpholin-4-ylsulfonylbenzohydrazide
CID 24656139
3-(4-acetylpiperazin-1-yl)sulfonyl-N'-[2-(4-chloro-2-methylphenoxy)acetyl]benzohydrazide
CID 24981818
3-chloro-4-hydroxy-N'-(3-morpholin-4-ylsulfonylbenzoyl)benzohydrazide
CID 24982115
N'-(4-methoxybenzoyl)-3-morpholin-4-ylsulfonylbenzohydrazide
CID 2514778
4-methoxy-N'-[4-(morpholine-4-sulfonyl)benzoyl]benzohydrazide
CID 1146584
N-[(3-chlorophenyl)methyl]-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 2682721
N'-[2-(4-bromophenoxy)acetyl]-2-chloro-5-morpholin-4-ylsulfonylbenzohydrazide
CID 2409154
2,4-dichloro-N-methyl-5-morpholin-4-ylsulfonyl-N-(2-phenoxyethyl)benzamide
CID 24687395

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide?
The IUPAC name of 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide (CID 25161543) is 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide.
What is the SMILES notation for 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide?
The canonical SMILES for 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide is CCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)cc1.
What is the InChIKey of 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide?
The InChIKey is SGEYWTAGVJNXNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O6S/c1-2-30-15-5-3-14(4-6-15)19(25)22-23-20(26)17-13-16(7-8-18(17)21)31(27,28)24-9-11-29-12-10-24/h3-8,13H,2,9-12H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide?
2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide has a molecular weight of 467.93 g/mol, XLogP of 1.83, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-(4-ethoxybenzoyl)-5-morpholin-4-ylsulfonylbenzohydrazide is sourced from PubChem (CID 25161543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).