(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide

C18H20ClNO4S — CID 110518758

IUPAC(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide
SMILESCCCOc1c(Cl)cc(/C=N\S(=O)(=O)c2ccccc2)cc1OCC
InChIInChI=1S/C18H20ClNO4S/c1-3-10-24-18-16(19)11-14(12-17(18)23-4-2)13-20-25(21,22)15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3/b20-13-
InChIKeyIELKENUHKPACCA-MOSHPQCFSA-N
MW381.88 g/mol
LogP4.34
Rot. Bonds8

About (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide

(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide (PubChem CID 110518758) has the molecular formula C18H20ClNO4S and a molecular weight of 381.88 g/mol. Its IUPAC name is (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide.

Molecular Properties

Compound Name(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide
PubChem CID110518758
Molecular FormulaC18H20ClNO4S
Molecular Weight381.88 g/mol
Exact Mass381.08
IUPAC Name(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide
SMILESCCCOc1c(Cl)cc(/C=N\S(=O)(=O)c2ccccc2)cc1OCC
InChIInChI=1S/C18H20ClNO4S/c1-3-10-24-18-16(19)11-14(12-17(18)23-4-2)13-20-25(21,22)15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3/b20-13-
InChIKeyIELKENUHKPACCA-MOSHPQCFSA-N
XLogP4.34
TPSA64.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.88
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide 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

(NZ)-N-[(3-bromo-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide
CID 110518761
N-[(Z)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-2-phenylacetamide
CID 110515314
N-[(E)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-4-fluorobenzenesulfonamide
CID 110516392
4-chloro-N-[(E)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]aniline
CID 110506129
N-[(E)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-4-propan-2-yloxybenzenesulfonamide
CID 110517653
(Z)-1-(3-chloro-5-ethoxy-4-propoxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
CID 110508637
(NE)-N-[[3-chloro-5-ethoxy-4-(3-phenylpropoxy)phenyl]methylidene]hydroxylamine
CID 42206329
(NZ)-N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]thiophene-2-sulfonamide
CID 110518596
N-[(Z)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-2-fluorobenzamide
CID 9235761
2-[(Z)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]oxyacetamide
CID 7706844
1,5-dichloro-3-ethoxy-2-propoxybenzene
CID 125116590
(NZ)-N-[(3,5-dichloro-4-ethoxyphenyl)methylidene]thiophene-2-sulfonamide
CID 110518583

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide?
The IUPAC name of (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide (CID 110518758) is (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide.
What is the SMILES notation for (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide?
The canonical SMILES for (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide is CCCOc1c(Cl)cc(/C=N\S(=O)(=O)c2ccccc2)cc1OCC.
What is the InChIKey of (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide?
The InChIKey is IELKENUHKPACCA-MOSHPQCFSA-N. The full InChI is InChI=1S/C18H20ClNO4S/c1-3-10-24-18-16(19)11-14(12-17(18)23-4-2)13-20-25(21,22)15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3/b20-13-.
What are the key properties of (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide?
(NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide has a molecular weight of 381.88 g/mol, XLogP of 4.34, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]benzenesulfonamide is sourced from PubChem (CID 110518758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).