설폭손

Sulfoxone

HCID 5351

기본 정보

CAS
144-75-2
표준 SMILES
O=S(O)CNc1ccc(S(=O)(=O)c2ccc(NCS(=O)O)cc2)cc1
InChIKey
NEDPPCHNEOMTJV-UHFFFAOYSA-N
분자식
C14H16N2O6S3
평균 분자량
404.5 g/mol
단동위원소 질량
404.01704923

개요

Aldesulfone is a sulfonamide.

이름 및 식별자

우선 이름
Sulfoxone
IUPAC
[4-[4-(sulfinomethylamino)phenyl]sulfonylanilino]methanesulfinic acid
현지명
설폭손
영어명
sulfoxone
분자식
C14H16N2O6S3
분자량
404.48

이름 및 동의어

sulfoxoneAldesulfoneAldesulphone144-76-3aldesulfon sodium0G3C18OH4DDTXSID80162594Methanesulfinic acid, (sulfonylbis(4,1-phenyleneimino))bis-((4-((4-((sulfinomethyl)amino)benzene)sulfonyl)phenyl)amino)methanesulfinic acid{[4-({4-[(sulfinomethyl)amino]benzene}sulfonyl)phenyl]amino}methanesulfinic acidRefChem:889709DTXCID50196725
이름 더 보기
설폭손Sulfoxone (Aldesulfone)NEDPPCHNEOMTJV-UHFFFAOYSA-NMethanesulfinic acid, 1,1'-[sulfonylbis(4,1-phenyleneimino)]bis-[[4-[4-(sulfinomethylamino)phenyl]sulfonylphenyl]amino]methanesulfinic acid
1,1'-(Sulfonylbis(4,1-phenyleneimino))bis(methanesulfinic acid)Sodium sulfoxoneSodium aldesulphoneDiasoneAldesulfon[4-[4-(sulfinomethylamino)phenyl]sulfonylanilino]methanesulfinic acid((sulfonylbis(4,1-phenylene))bis(azanediyl))dimethanesulfinic acidUNII-0G3C18OH4D

데이터베이스 식별자

CAS
144-75-2、144-76-3
PubChem CID
5351
DTXSID
DTXSID80162594
ChEMBL
CHEMBL1570
ChEBI
CHEBI:135651
UNII
0G3C18OH4D

물성

구조 계산 물성

XLogP
1.2
극성 표면적
180 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
10
회전 가능 결합 수
8
무거운 원자 수
25

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15
LogP-2.8
Solubility2.63e+00 g/L
Physical DescriptionSolid

물리화학적 성질

끓는 점
857.3 · 857.3±75.0 °C(Predicted)
밀도
1.753 · 1.753±0.06 g/cm3(Predicted)
산도 계수 (pKa)
2.58 · 2.58±0.10(Predicted)

화학 및 산업

약리 정보

Protein Binding69%
Pharmacodynamics · 1건

Sulfoxone is a sulfonamide antibiotic. The sulfonamides are synthetic bacteriostatic antibiotics with a wide spectrum against most gram-positive and many gram-negative organisms. However, many strains of an individual species may be resistant. Sulfonamides inhibit multiplication of bacteria by acting as competitive inhibitors of <i>p</i>-aminobenzoic acid in the folic acid metabolism cycle. Bacterial sensitivity is the same for the various sulfonamides, and resistance to one sulfonamide indicates resistance to all. Most sulfonamides are readily absorbed orally. However, parenteral administration is difficult, since the soluble sulfonamide salts are highly alkaline and irritating to the tissues. The sulfonamides are widely distributed throughout all tissues. High levels are achieved in pleural, peritoneal, synovial, and ocular fluids. Although these drugs are no longer used to treat meningitis, CSF levels are high in meningeal infections. Their antibacterial action is inhibited by pus.

Mechanism of Action · 1건

Sulfoxone is a competitive inhibitor of bacterial enzyme dihydropteroate synthetase. The normal substrate for the enzyme, para-aminobenzoic acid (PABA) cannot bind as usual. The inhibited reaction is necessary in these organisms for the synthesis of folic acid.

Biological Half-Life3-8 hours
Metabolism/MetabolitesHepatic.
Absorption, Distribution and ExcretionRapidly absorbed.

공급사1 곳

湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]

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