ethyl 1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carboxylate

Modify Date: 2025-10-20 18:18:22

ethyl 1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carboxylate Structure
ethyl 1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carboxylate structure
Common Name ethyl 1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carboxylate
CAS Number 180905-84-4 Molecular Weight 328.77100
Density 1.46g/cm3 Boiling Point 529.8ºC at 760 mmHg
Molecular Formula C13H13ClN2O4S Melting Point N/A
MSDS N/A Flash Point 274.2ºC

 Names

Name ethyl 1-(2-amino-5-chlorophenyl)sulfonylpyrrole-2-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.46g/cm3
Boiling Point 529.8ºC at 760 mmHg
Molecular Formula C13H13ClN2O4S
Molecular Weight 328.77100
Flash Point 274.2ºC
Exact Mass 328.02800
PSA 99.77000
LogP 3.79940
Vapour Pressure 2.61E-11mmHg at 25°C
Index of Refraction 1.625
InChIKey SMNXJEBYPOVRHP-UHFFFAOYSA-N
SMILES CCOC(=O)c1cccn1S(=O)(=O)c1cc(Cl)ccc1N

 Bioassay

View more

Name: Effective concentration against HIV-1 induced cytopathicity in MT-4 cells using MTT m...
Source: ChEMBL
Target: MT4
External Id: CHEMBL884502
Name: HIV RT Assay from Article 10.1021/jm950568w: "2-Sulfonyl-4-chloroanilino moiety: a po...
Source: BindingDB
Target: N/A
External Id: BindingDB_430_1
Name: Effective concentration against HIV-1 induced cytopathogenicity in MT-4 cells
Source: ChEMBL
Target: MT4
External Id: CHEMBL712401
Name: Concentration required to reduce the viability of mock-infected MT-4 cells by 50%
Source: ChEMBL
Target: MT4
External Id: CHEMBL709816
Name: HIV-1 RT Assay from Article 10.1021/jm9901125: "Structure-based design, synthesis, an...
Source: BindingDB
Target: N/A
External Id: BindingDB_433_1
Name: HIV Enzyme Data
Source: NIAID
Target: N/A
External Id: HIV Enzyme Data
Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data
Name: Selectivity index expressed as the ratio of CC50/ EC50
Source: ChEMBL
Target: MT4
External Id: CHEMBL840536
Name: 50% cytotoxic concentration against mock-infected MT-4 cells using MTT method
Source: ChEMBL
Target: MT4
External Id: CHEMBL883097
Name: Potency against non nucleoside reverse transcriptor was determined in MT-4 cells
Source: ChEMBL
Target: MT4
External Id: CHEMBL706845
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 Synonyms

2-amino-5-chlorophenyl 2-ethoxycarbonyl-1H-pyrrol-1-yl sulfone
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