3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide

C16H15ClN4O3S — CID 666061

IUPAC3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide
SMILESO=S(=O)(Nc1nc2ccccc2nc1NCCO)c1cccc(Cl)c1
InChIInChI=1S/C16H15ClN4O3S/c17-11-4-3-5-12(10-11)25(23,24)21-16-15(18-8-9-22)19-13-6-1-2-7-14(13)20-16/h1-7,10,22H,8-9H2,(H,18,19)(H,20,21)
InChIKeyIKVMDTZOVHAQKU-UHFFFAOYSA-N
MW378.84 g/mol
LogP2.49
Rot. Bonds6

About 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide

3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide (PubChem CID 666061) has the molecular formula C16H15ClN4O3S and a molecular weight of 378.84 g/mol. Its IUPAC name is 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide.

Molecular Properties

Compound Name3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide
PubChem CID666061
Molecular FormulaC16H15ClN4O3S
Molecular Weight378.84 g/mol
Exact Mass378.06
IUPAC Name3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide
SMILESO=S(=O)(Nc1nc2ccccc2nc1NCCO)c1cccc(Cl)c1
InChIInChI=1S/C16H15ClN4O3S/c17-11-4-3-5-12(10-11)25(23,24)21-16-15(18-8-9-22)19-13-6-1-2-7-14(13)20-16/h1-7,10,22H,8-9H2,(H,18,19)(H,20,21)
InChIKeyIKVMDTZOVHAQKU-UHFFFAOYSA-N
XLogP2.49
TPSA104.21 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.84
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]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

N-[3-(allylamino)-2-quinoxalinyl]-4-chlorobenzenesulfonamide
CID 2055374
2-{4-[(4-Chlorophenyl)sulfonyl]piperazino}-3-ethylquinoxaline
CID 2808993
4-chloro-N-{3-[4-(2-fluorophenyl)-1-piperazinyl]-2-quinoxalinyl}benzenesulfonamide
CID 1325905
3-[(3-{[(4-Chlorophenyl)sulfonyl]amino}-2-quinoxalinyl)amino]benzenesulfonamide
CID 5202109
3-chloro-N-[3-(2-morpholin-4-ylethylamino)quinoxalin-2-yl]benzenesulfonamide
CID 666487
2,5-dichloro-N-(3-((3-methoxypropyl)amino)quinoxalin-2-yl)benzenesulfonamide
CID 1621617
1-allyl-3-((3-chlorophenyl)sulfonyl)-2,3-dihydro-1H-imidazo[4,5-b]quinoxaline
CID 1866414
3-(3-chlorophenyl)sulfonyl-1-(3-propan-2-yloxypropyl)-2H-imidazo[4,5-b]quinoxaline
CID 2021218
1-((3-chlorophenyl)sulfonyl)-3-(2-methoxyethyl)-2,3-dihydro-1H-imidazo[4,5-b]quinoxaline
CID 2023935
1-((4-chlorophenyl)sulfonyl)-3-(3-ethoxypropyl)-2,3-dihydro-1H-imidazo[4,5-b]quinoxaline
CID 2032377
N-[4-[(3-chloroquinoxalin-2-yl)-methylsulfamoyl]phenyl]acetamide
CID 2311673
2,5-difluoro-N-[3-[4-(2-hydroxyethyl)piperazin-1-yl]quinoxalin-2-yl]benzenesulfonamide
CID 2560544

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide?
The IUPAC name of 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide (CID 666061) is 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide.
What is the SMILES notation for 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide?
The canonical SMILES for 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide is O=S(=O)(Nc1nc2ccccc2nc1NCCO)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide?
The InChIKey is IKVMDTZOVHAQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN4O3S/c17-11-4-3-5-12(10-11)25(23,24)21-16-15(18-8-9-22)19-13-6-1-2-7-14(13)20-16/h1-7,10,22H,8-9H2,(H,18,19)(H,20,21).
What are the key properties of 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide?
3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide has a molecular weight of 378.84 g/mol, XLogP of 2.49, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[3-(2-hydroxyethylamino)quinoxalin-2-yl]benzenesulfonamide is sourced from PubChem (CID 666061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).